0 B14R1.156 C#CCNC(=O)C=CC1=CC=CC=C1 MCULE-5601606607 [0,0,0,0,0,0|1,0,1]=2 1 B14R1.156 C#CCNC(=O)CCC1=CC=CC=C1 MCULE-1046200342 [0,0,0,0,0,0|1,0,3]=4 2 B14R1.156 C#CCNC(=O)COC1=CC=CC=C1 MCULE-9348943497 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.156 C#CCNC(=O)OCC1=CC=CC=C1 MCULE-9016607522 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.156 C=CCNC(=O)C#CC1=CC=CC=C1 MCULE-3196256873 [0,0,0,0,0,0|1,0,3]=4 5 B14R1.156 C=CCNC(=O)C=CC1=CC=CC=C1 MCULE-5529716741 [0,0,0,0,0,0|1,0,1]=2 6 B14R1.156 C=CCNC(=O)CCC1=CC=CC=C1 MCULE-8691570535 [0,0,0,0,0,0|1,0,3]=4 7 B14R1.156 C=CCNC(=O)COC1=CC=CC=C1 MCULE-1603145719 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.156 C=CCNC(=O)CSC1=CC=CC=C1 MCULE-1648093185 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.156 C=CCNC(=O)OCC1=CC=CC=C1 MCULE-6555030961 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.156 C=CCOC(=O)/C=C/C1=CC=CC=C1 MCULE-4587107863 [0,0,0,0,0,0|2,0,1]=3 11 B14R1.156 C=CCOC(=O)C=CC1=CC=CC=C1 MCULE-3880403828 [0,0,0,0,0,0|2,0,1]=3 12 B14R1.156 CC(COC1=CC=CC=C1)NCCO MCULE-6883756608 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.156 CCCCC(=O)C#CC1=CC=CC=C1 MCULE-7118004172 [0,0,0,0,0,0|2,0,2]=4 14 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 MCULE-5616525060 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.156 CCCNC(=O)CSC1=CC=CC=C1 MCULE-5590739808 [0,0,0,0,0,0|2,0,1]=3 16 B14R1.156 CCCNC(=O)NCC1=CC=NC=C1 MCULE-3744544276 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.156 CCCOC(=O)/C=C/C1=CC=CC=C1 MCULE-2404690136 [0,0,0,0,0,0|2,0,0]=2 18 B14R1.156 CCCOC(=O)C=CC1=CC=CC=C1 MCULE-2672503857 [0,0,0,0,0,0|2,0,0]=2 19 B14R1.156 CCNNC(=O)OCC1=CC=CC=C1 MCULE-3224099312 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.156 COCNC(=O)OCC1=CC=CC=C1 MCULE-3291624519 [0,0,0,0,0,0|3,0,1]=4 21 B14R1.156 N#CCNC(=O)OCC1=CC=CC=C1 MCULE-5150754784 [0,0,0,0,0,0|2,0,2]=4 22 B14R1.156 N#CCOC(=O)C=CC1=CC=CC=C1 MCULE-6976950945 [0,0,0,0,0,0|2,0,1]=3 23 B14R1.156 NCCCC(=O)OCC1=CC=CC=C1 MCULE-4421161071 [0,0,0,0,0,0|3,0,1]=4 24 B14R1.156 NCCCC(=O)OCC1=CC=CC=C1 MCULE-7630962615 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.156 NCCCC(=O)OCC1=CC=CC=C1 MCULE-9399058680 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.156 NCCNC(=O)COC1=CC=CC=C1 MCULE-6633745738 [0,0,0,0,0,0|2,0,1]=3 27 B14R1.156 NCCNC(=O)COC1=CC=CC=C1 MCULE-9269435364 [0,0,0,0,0,0|2,0,1]=3 28 B14R1.156 NCCNC(=O)NCC1=CC=CC=C1 MCULE-1882227961 [0,0,0,0,0,0|2,0,1]=3 29 B14R1.156 NCCNC(=O)NCC1=CC=CC=C1 MCULE-3435678594 [0,0,0,0,0,0|2,0,1]=3 30 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 MCULE-5091402269 [0,0,0,0,0,0|2,0,1]=3 31 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 MCULE-6251666047 [0,0,0,0,0,0|2,0,1]=3 32 B14R1.156 O=C(C#CC1=CC=CC=C1)CCCCl MCULE-3329862107 [0,0,0,0,0,0|2,0,2]=4 33 B14R1.156 O=C(C=CC1=CC=CC=C1)NCCBr MCULE-6855858353 [0,0,0,0,0,0|1,0,0]=1 34 B14R1.156 O=C(C=CC1=CC=CC=C1)NCCO MCULE-8482437358 [0,0,0,0,0,0|0,0,0]=0 35 B14R1.156 O=C(CCC1=CC=CC=C1)NCCBr MCULE-4613116532 [0,0,0,0,0,0|1,0,2]=3 36 B14R1.156 O=C(CCC1=CC=CC=C1)NCCO MCULE-2147552681 [0,0,0,0,0,0|0,0,2]=2 37 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 MCULE-7128283672 [0,0,0,0,0,0|3,0,1]=4 38 B14R1.156 O=C(CCCO)NCC1=CC=CC=C1 MCULE-6329513683 [0,0,0,0,0,0|2,0,1]=3 39 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 MCULE-6249999919 [0,0,0,0,0,0|2,0,1]=3 40 B14R1.156 O=C(CSC1=NC=CC=N1)NCCO MCULE-4688958109 [0,0,0,0,0,0|3,0,1]=4 41 B14R1.156 O=C(NCC1=CC=CC=C1)OCCO MCULE-4526654281 [0,0,0,0,0,0|2,0,1]=3 42 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 MCULE-6974797354 [0,0,0,0,0,0|2,0,1]=3 43 B14R1.156 O=C(NCCI)OCC1=CC=CC=C1 MCULE-3420736776 [0,0,0,0,0,0|2,0,1]=3 44 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 MCULE-7411524282 [0,0,0,0,0,0|1,0,1]=2 45 B14R1.156 O=CCNC(=O)OCC1=CC=CC=C1 MCULE-4761858194 [0,0,0,0,0,0|1,0,3]=4 46 B14R1.156 OCCNC(=S)NCC1=CC=CC=C1 MCULE-8109137588 [0,0,0,0,0,0|1,1,1]=3 47 B13R1.28 C=CCNC/C=C/C1=CC=CC=C1 MCULE-3165699700 [1,0,0,0,0,0|1,0,2]=4 48 B13R1.28 C=CCNCC=CC1=CC=CC=C1 MCULE-3302787683 [1,0,0,0,0,0|1,0,2]=4 49 B13R1.28 C=CCNCC=CC1=CC=CC=C1 MCULE-8868134628 [1,0,0,0,0,0|1,0,2]=4 50 B13R1.28 CCCNC/C=C/C1=CC=CC=C1 MCULE-6086483688 [1,0,0,0,0,0|1,0,1]=3 51 B13R1.28 CCCNC/C=C/C1=CC=CC=C1 MCULE-7520445939 [1,0,0,0,0,0|1,0,1]=3 52 B13R1.28 CCCNCC=CC1=CC=CC=C1 MCULE-8770833507 [1,0,0,0,0,0|1,0,1]=3 53 B13R1.28 CCCNCC=CC1=CC=CC=C1 MCULE-9040640785 [1,0,0,0,0,0|1,0,1]=3 54 B13R1.28 OCCNC/C=C/C1=CC=CC=C1 MCULE-3193799840 [1,0,0,0,0,0|0,0,1]=2 55 B13R1.28 OCCNC/C=C/C1=CC=CC=C1 MCULE-8311071804 [1,0,0,0,0,0|0,0,1]=2 56 B13R1.28 OCCNCC#CC1=CC=CC=C1 MCULE-5452971572 [1,0,0,0,0,0|0,0,3]=4 57 B13R1.28 OCCNCC=CC1=CC=CC=C1 MCULE-2725682127 [1,0,0,0,0,0|0,0,1]=2 58 B13R1.28 OCCNCC=CC1=CC=CC=C1 MCULE-9466375084 [1,0,0,0,0,0|0,0,1]=2 59 B13R1.28 OOCCCC=CC1=CC=CC=C1 MCULE-7527390093 [1,0,0,0,0,0|2,0,1]=4 60 B13R1.42 C=COC(=O)/C=C/C1=CC=CC=C1 MCULE-7658509863 [1,0,0,0,0,0|1,0,2]=4 61 B13R1.42 C=COC(=O)C=CC1=CC=CC=C1 MCULE-3743204129 [1,0,0,0,0,0|1,0,2]=4 62 B13R1.42 CCCC(=O)C#CC1=CC=CC=C1 MCULE-7298759546 [1,0,0,0,0,0|1,0,2]=4 63 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 MCULE-2627209248 [1,0,0,0,0,0|1,0,2]=4 64 B13R1.42 CCCC(=O)NCC1=CC=CC=C1 MCULE-9053492552 [1,0,0,0,0,0|2,0,1]=4 65 B13R1.42 CCCC(=O)NNC1=CC=CC=C1 MCULE-4300209612 [1,0,0,0,0,0|3,0,0]=4 66 B13R1.42 CCCC(=O)OCC1=CC=CC=C1 MCULE-3975576393 [1,0,0,0,0,0|2,0,1]=4 67 B13R1.42 CCNC(=O)CCC1=CC=CC=C1 MCULE-2464553678 [1,0,0,0,0,0|0,0,2]=3 68 B13R1.42 CCNC(=O)NCC1=CC=CC=C1 MCULE-4104238611 [1,0,0,0,0,0|1,0,1]=3 69 B13R1.42 CCNC(=O)NCC1=CC=NC=C1 MCULE-6864460518 [1,0,0,0,0,0|2,0,1]=4 70 B13R1.42 CCNC(=S)NCC1=CC=CC=C1 MCULE-8798982768 [1,0,0,0,0,0|1,1,1]=4 71 B13R1.42 CCNC(=S)NNC1=CC=CC=C1 MCULE-4726321116 [1,0,0,0,0,0|2,1,0]=4 72 B13R1.42 CCOC(=O)/C=C/C1=CC=CC=C1 MCULE-6465000630 [1,0,0,0,0,0|1,0,0]=2 73 B13R1.42 CCOC(=O)/C=C/C1=CC=CC=N1 MCULE-1211328616 [1,0,0,0,0,0|2,0,0]=3 74 B13R1.42 CCOC(=O)/C=C/C1=CC=CN=C1 MCULE-8467322888 [1,0,0,0,0,0|2,0,0]=3 75 B13R1.42 CCOC(=O)/C=C/C1=CC=NC=C1 MCULE-6184595268 [1,0,0,0,0,0|2,0,0]=3 76 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 MCULE-3735412410 [1,0,0,0,0,0|1,0,2]=4 77 B13R1.42 CCOC(=O)C=CC1=CC=CC=C1 MCULE-8395432408 [1,0,0,0,0,0|1,0,0]=2 78 B13R1.42 CCOC(=O)C=CC1=CC=CN=C1 MCULE-5796634871 [1,0,0,0,0,0|2,0,0]=3 79 B13R1.42 CCOC(=O)C=CC1=CC=NC=C1 MCULE-7884928993 [1,0,0,0,0,0|2,0,0]=3 80 B13R1.42 CCOC(=O)C=CC1=CN=CN=C1 MCULE-8958436004 [1,0,0,0,0,0|3,0,0]=4 81 B13R1.42 CCOC(=O)C=CC1=NC=CC=C1 MCULE-7444408003 [1,0,0,0,0,0|2,0,0]=3 82 B13R1.42 CCOC(=O)C=NC1=CC=CC=C1 MCULE-7850099028 [1,0,0,0,0,0|2,0,0]=3 83 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 MCULE-3812518027 [1,0,0,0,0,0|1,0,2]=4 84 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 MCULE-3246042152 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 MCULE-6336658963 [1,0,0,0,0,0|2,0,1]=4 86 B13R1.42 CCOC(=O)COC1=CC=CC=C1 MCULE-9720196372 [1,0,0,0,0,0|2,0,1]=4 87 B13R1.42 CCOC(=O)CSC1=CC=CC=C1 MCULE-2587463573 [1,0,0,0,0,0|2,0,1]=4 88 B13R1.42 CCOC(=O)NCC1=CC=CC=C1 MCULE-5346256483 [1,0,0,0,0,0|2,0,1]=4 89 B13R1.42 CCOC(=O)NNC1=CC=CC=C1 MCULE-6253222440 [1,0,0,0,0,0|3,0,0]=4 90 B13R1.42 CCSC(=O)NCC1=CC=CC=C1 MCULE-1542299425 [1,0,0,0,0,0|2,0,1]=4 91 B13R1.42 CNNC(=O)COC1=CC=CC=C1 MCULE-1198754391 [1,0,0,0,0,0|2,0,1]=4 92 B13R1.42 CNNC(=O)OCC1=CC=CC=C1 MCULE-4156080107 [1,0,0,0,0,0|2,0,1]=4 93 B13R1.42 CNNC(=O)OCC1=CC=CC=C1 MCULE-6993481201 [1,0,0,0,0,0|2,0,1]=4 94 B13R1.42 N#CSC(=O)C=CC1=CC=CC=C1 MCULE-7730374051 [1,0,0,0,0,0|2,0,1]=4 95 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 MCULE-2495183110 [1,0,0,0,0,0|2,0,1]=4 96 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 MCULE-2579881726 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 MCULE-2533439169 [1,0,0,0,0,0|2,0,1]=4 98 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 MCULE-4298783563 [1,0,0,0,0,0|2,0,1]=4 99 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 MCULE-5360776035 [1,0,0,0,0,0|2,0,1]=4 100 B13R1.42 O=C(/C=C/C1=CC=CC=C1)N=C=S MCULE-7812622066 [1,0,0,0,0,0|0,1,2]=4 101 B13R1.42 O=C(C=CC1=CC=CC=C1)N=C=S MCULE-1260924716 [1,0,0,0,0,0|0,1,2]=4 102 B13R1.42 O=C(CCBr)NCC1=CC=CC=C1 MCULE-2968487112 [1,0,0,0,0,0|2,0,1]=4 103 B13R1.42 O=C(CCBr)OCC1=CC=CC=C1 MCULE-7643486663 [1,0,0,0,0,0|2,0,1]=4 104 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 MCULE-2526925294 [1,0,0,0,0,0|2,0,1]=4 105 B13R1.42 O=C(CCCl)OCC1=CC=CC=C1 MCULE-7861283912 [1,0,0,0,0,0|2,0,1]=4 106 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 MCULE-2392960294 [1,0,0,0,0,0|2,0,1]=4 107 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 MCULE-3963836992 [1,0,0,0,0,0|1,0,1]=3 108 B13R1.42 O=C(NCCl)OCC1=CC=CC=C1 MCULE-2921599080 [1,0,0,0,0,0|2,0,1]=4 109 B13R1.42 O=C(NCO)OCC1=CC=CC=C1 MCULE-1918801600 [1,0,0,0,0,0|1,0,1]=3 110 B15R1.78 C#CCCNC(=O)C=CC1=CC=CC=C1 MCULE-3084828270 [0,1,0,0,0,0|1,0,0]=2 111 B15R1.78 C#CCCNC(=O)NCC1=CC=CC=C1 MCULE-8434805292 [0,1,0,0,0,0|2,0,1]=4 112 B15R1.78 C#CCCNC(=O)OCC1=CC=CC=C1 MCULE-5968904541 [0,1,0,0,0,0|2,0,1]=4 113 B15R1.78 C=CCCNC(=O)OCC1=CC=CC=C1 MCULE-5275866981 [0,1,0,0,0,0|2,0,1]=4 114 B15R1.78 CCCCNC(=O)CCC1=CC=CC=C1 MCULE-1998676091 [0,1,0,0,0,0|1,0,2]=4 115 B15R1.78 CCCCNC(=O)OCC1=CC=CC=C1 MCULE-1046690627 [0,1,0,0,0,0|2,0,1]=4 116 B15R1.78 CCCCOC(=O)/C=C/C1=CC=CC=C1 MCULE-1597785199 [0,1,0,0,0,0|2,0,0]=3 117 B15R1.78 CCCCOC(=O)C=CC1=CC=CC=C1 MCULE-7483218833 [0,1,0,0,0,0|2,0,0]=3 118 B15R1.78 CNCCNC(=O)NCC1=CC=CC=C1 MCULE-1189288116 [0,1,0,0,0,0|2,0,1]=4 119 B15R1.78 CNCCNC(=O)NCC1=CC=CC=C1 MCULE-3705742776 [0,1,0,0,0,0|2,0,1]=4 120 B15R1.78 CNCCNC(=O)OCC1=CC=CC=C1 MCULE-2256655706 [0,1,0,0,0,0|2,0,1]=4 121 B15R1.78 CNCCNC(=O)OCC1=CC=CC=C1 MCULE-7820439045 [0,1,0,0,0,0|2,0,1]=4 122 B15R1.78 COCCNC(=O)C=CC1=CC=CC=C1 MCULE-4117808280 [0,1,0,0,0,0|0,0,0]=1 123 B15R1.78 COCCNC(=O)COC1=CC=CC=C1 MCULE-9989831598 [0,1,0,0,0,0|1,0,1]=3 124 B15R1.78 COCCNC(=O)NCC1=CC=NC=C1 MCULE-5654581545 [0,1,0,0,0,0|2,0,1]=4 125 B15R1.78 COCCNC(=O)NCC1=CN=CC=C1 MCULE-2072822735 [0,1,0,0,0,0|2,0,1]=4 126 B15R1.78 COCCNC(=O)NCC1=NC=CC=C1 MCULE-4905664892 [0,1,0,0,0,0|2,0,1]=4 127 B15R1.78 COCCNC(=S)NNC1=CC=CC=C1 MCULE-4883560549 [0,1,0,0,0,0|2,1,0]=4 128 B15R1.78 N#CCCNC(=O)OCC1=CC=CC=C1 MCULE-3550324917 [0,1,0,0,0,0|2,0,1]=4 129 B15R1.78 NCCCNC(=O)C=CC1=CC=CC=C1 MCULE-5547583143 [0,1,0,0,0,0|1,0,0]=2 130 B15R1.78 NCCCNC(=O)C=CC1=CC=CC=C1 MCULE-8582720472 [0,1,0,0,0,0|1,0,0]=2 131 B15R1.78 NCCCNC(=O)NCC1=CC=CC=C1 MCULE-2564858815 [0,1,0,0,0,0|2,0,1]=4 132 B15R1.78 NCCCNC(=O)NCC1=CC=CC=C1 MCULE-6468818648 [0,1,0,0,0,0|2,0,1]=4 133 B15R1.78 NCCCNC(=O)OCC1=CC=CC=C1 MCULE-3759132887 [0,1,0,0,0,0|2,0,1]=4 134 B15R1.78 NCCCNC(=O)OCC1=CC=CC=C1 MCULE-9668763917 [0,1,0,0,0,0|2,0,1]=4 135 B15R1.78 NOCCNC(=O)OCC1=CC=CC=C1 MCULE-5230504528 [0,1,0,0,0,0|1,0,1]=3 136 B15R1.78 O=C(C=CC1=CC=CC=C1)NCCCO MCULE-6205343866 [0,1,0,0,0,0|0,0,0]=1 137 B15R1.78 O=C(CCC1=CC=CC=C1)NCCCO MCULE-4860254357 [0,1,0,0,0,0|0,0,2]=3 138 B15R1.78 O=C(CCCCO)NCC1=CC=CC=C1 MCULE-9423754691 [0,1,0,0,0,0|2,0,1]=4 139 B15R1.78 O=C(CCCCO)OCC1=CC=CC=C1 MCULE-2086831743 [0,1,0,0,0,0|2,0,1]=4 140 B15R1.78 O=C(CSC1=CC=CC=C1)NCCCCl MCULE-7478587578 [0,1,0,0,0,0|2,0,1]=4 141 B15R1.78 O=C(NCCCBr)OCC1=CC=CC=C1 MCULE-2809494389 [0,1,0,0,0,0|2,0,1]=4 142 B15R1.78 O=C(NCCCCl)OCC1=CC=CC=C1 MCULE-4624740637 [0,1,0,0,0,0|2,0,1]=4 143 B15R1.78 O=C(NCCCO)OCC1=CC=CC=C1 MCULE-1907531173 [0,1,0,0,0,0|1,0,1]=3 144 B15R1.78 O=C(NOCCO)OCC1=CC=CC=C1 MCULE-7154960750 [0,1,0,0,0,0|1,0,1]=3 145 B15R1.78 O=CCCNC(=O)OCC1=CC=CC=C1 MCULE-1298983112 [0,1,0,0,0,0|1,0,2]=4 146 B15R1.115 C/C(=C\C(=O)C1=CC=CC=C1)/NCC#N MCULE-6961403441 [0,1,0,0,0,0|2,0,1]=4 147 B15R1.115 C=CCNC(=O)NC(=S)C1=CC=CC=C1 MCULE-6579938783 [0,1,0,0,0,0|2,0,1]=4 148 B15R1.115 CC(=CC(=O)C1=CC=CC=C1)NCC#N MCULE-5444161910 [0,1,0,0,0,0|2,0,1]=4 149 B15R1.115 CC(NC(=S)NCCO)C1=CC=CC=C1 MCULE-7729837295 [0,1,0,0,0,0|1,1,1]=4 150 B15R1.115 CCCNC(=S)NC(=O)C1=CC=CC=C1 MCULE-1647334856 [0,1,0,0,0,0|2,1,0]=4 151 B15R1.115 NCCNC(=O)CC(N)C1=CC=CC=C1 MCULE-6122714284 [0,1,0,0,0,0|1,0,2]=4 152 B15R1.115 NCCNC(=O)CC(N)C1=CC=CC=C1 MCULE-7573521020 [0,1,0,0,0,0|1,0,2]=4 153 B15R1.115 O=C(CCCO)CC(=O)C1=CC=CC=C1 MCULE-5043714121 [0,1,0,0,0,0|1,0,1]=3 154 B15R1.115 O=C(NC(=S)NCCO)C1=CC=CC=C1 MCULE-9921911777 [0,1,0,0,0,0|1,1,0]=3 155 B15R1.115 O=C(NCCO)NC(=S)C1=CC=CC=C1 MCULE-2974756670 [0,1,0,0,0,0|1,0,0]=2 156 B15R1.115 O=C(NCCO)NC(=S)C1=CN=CC=C1 MCULE-8216108265 [0,1,0,0,0,0|2,0,0]=3 157 B15R1.127 CC1=CC(=CC=C1)OCC(=O)NCCN MCULE-4665516009 [0,1,0,0,0,0|2,0,1]=4 158 B15R1.127 CC1=CC(=CC=C1)OCC(=O)NCCN MCULE-7786104772 [0,1,0,0,0,0|2,0,1]=4 159 B15R1.127 CCCNC(=O)COC1=CC(=CC=C1)Cl MCULE-5338446477 [0,1,0,0,0,0|2,0,1]=4 160 B15R1.127 O=C(CCC1=CC=CC(=C1)Br)NCCO MCULE-7974211778 [0,1,0,0,0,0|0,0,2]=3 161 B15R1.139 CC1=CC=C(C=C1)CCC(=O)NCCO MCULE-8175835463 [0,1,0,0,0,0|0,0,2]=3 162 B15R1.139 CC1=CC=C(C=C1)CNC(=S)NCCO MCULE-5059494783 [0,1,0,0,0,0|1,1,1]=4 163 B15R1.139 CC1=CC=C(C=C1)OCC(=O)NCCO MCULE-2936496369 [0,1,0,0,0,0|1,0,1]=3 164 B15R1.139 CCCNC(=O)C=CC1=CC=C(C=C1)F MCULE-8221406145 [0,1,0,0,0,0|1,0,0]=2 165 B15R1.139 CCCNC(=O)CCC1=CC=C(C=C1)F MCULE-7922186577 [0,1,0,0,0,0|1,0,2]=4 166 B15R1.139 CCCNC(=O)CCC1=CC=C(C=C1)O MCULE-3338620920 [0,1,0,0,0,0|1,0,2]=4 167 B15R1.139 CCCNC(=O)COC1=CC=C(C=C1)N MCULE-6192422866 [0,1,0,0,0,0|2,0,1]=4 168 B15R1.139 CCCNC(=O)CSC1=CC=C(C=C1)C MCULE-3003167924 [0,1,0,0,0,0|2,0,1]=4 169 B15R1.139 CCCNC(=O)CSC1=CC=C(C=C1)Cl MCULE-2098374193 [0,1,0,0,0,0|2,0,1]=4 170 B15R1.139 N#CCNC(=O)C=CC1=CC=C(C=C1)Cl MCULE-7040891712 [0,1,0,0,0,0|1,0,1]=3 171 B15R1.139 O=C(CCCO)NCC1=CC=C(C=C1)F MCULE-7194744338 [0,1,0,0,0,0|2,0,1]=4 172 B15R1.139 O=C(COC1=CC=C(C=C1)Br)NCCO MCULE-3893344576 [0,1,0,0,0,0|1,0,1]=3 173 B15R1.551 C=CCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-9670473257 [0,1,0,0,0,0|2,0,1]=4 174 B15R1.551 CCCNC(=O)C(=CC1=CC=CC=C1)C MCULE-6933973944 [0,1,0,0,0,0|1,0,0]=2 175 B15R1.551 CCCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-1605630655 [0,1,0,0,0,0|2,0,0]=3 176 B15R1.551 CCCNC(=O)C(C)OC1=CC=CC=C1 MCULE-2129926030 [0,1,0,0,0,0|2,0,1]=4 177 B15R1.551 CCCNC(=O)C(N)CC1=CC=CC=C1 MCULE-2409223238 [0,1,0,0,0,0|1,0,2]=4 178 B15R1.551 CCCNC(=O)C(N)CC1=CC=CC=C1 MCULE-6887203096 [0,1,0,0,0,0|1,0,2]=4 179 B15R1.551 CCCNC(=O)N(C)CC1=CC=CC=C1 MCULE-7119763306 [0,1,0,0,0,0|2,0,1]=4 180 B15R1.551 NC(CC1=CC=CC=C1)C(=O)NCCO MCULE-3181211474 [0,1,0,0,0,0|0,0,2]=3 181 B15R1.551 NC(CC1=CC=CC=C1)C(=O)NCCO MCULE-5898384284 [0,1,0,0,0,0|0,0,2]=3 182 B15R1.551 NCCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-1184136379 [0,1,0,0,0,0|2,0,0]=3 183 B15R1.551 O=C(NCCO)C(=O)NC1=CC=CC=C1 MCULE-7031025387 [0,1,0,0,0,0|1,0,0]=2 184 B15R1.551 O=C(NCCO)C(=O)NC1=CC=CN=C1 MCULE-7958801625 [0,1,0,0,0,0|2,0,0]=3 185 B15R1.551 O=C(NCCO)C(=O)NC1=CC=NC=C1 MCULE-7321959365 [0,1,0,0,0,0|2,0,0]=3 186 B15R1.741 CC(CBr)NC(=O)OCC1=CC=CC=C1 MCULE-3634031599 [0,1,0,0,0,0|2,0,1]=4 187 B15R1.741 CC(CI)NC(=O)OCC1=CC=CC=C1 MCULE-5202626084 [0,1,0,0,0,0|2,0,1]=4 188 B15R1.741 CC(CN)NC(=O)OCC1=CC=CC=C1 MCULE-4090876806 [0,1,0,0,0,0|2,0,1]=4 189 B15R1.741 CC(CN)NC(=O)OCC1=CC=CC=C1 MCULE-9894403933 [0,1,0,0,0,0|2,0,1]=4 190 B15R1.741 CC(CO)NC(=O)OCC1=CC=CC=C1 MCULE-5375640009 [0,1,0,0,0,0|1,0,1]=3 191 B15R1.741 CC(CO)NC(=O)OCC1=CC=CC=C1 MCULE-9986605456 [0,1,0,0,0,0|1,0,1]=3 192 B15R1.741 CCC(C)NC(=O)C=CC1=CC=CC=C1 MCULE-4533209903 [0,1,0,0,0,0|1,0,0]=2 193 B15R1.741 CCC(C)NC(=O)CCC1=CC=CC=C1 MCULE-2918728658 [0,1,0,0,0,0|1,0,2]=4 194 B15R1.741 CCC(C)NC(=O)COC1=CC=CC=C1 MCULE-5158890853 [0,1,0,0,0,0|2,0,1]=4 195 B15R1.741 COC(=O)NC(=O)C=CC1=CC=CC=C1 MCULE-7679709273 [0,1,0,0,0,0|2,0,1]=4 196 B15R1.741 COC(=S)NC(=O)C=CC1=CC=CC=C1 MCULE-1846819116 [0,1,0,0,0,0|2,0,1]=4 197 B15R1.741 C[C@@H](CBr)NC(=O)OCC1=CC=CC=C1 MCULE-7979983254 [0,1,0,0,0,0|2,0,1]=4 198 B15R1.741 C[C@@H](CCl)NC(=O)OCC1=CC=CC=C1 MCULE-1892128427 [0,1,0,0,0,0|2,0,1]=4 199 B15R1.741 C[C@@H](CCl)NC(=O)OCC1=CC=CC=C1 MCULE-6512254163 [0,1,0,0,0,0|2,0,1]=4 200 B15R1.741 C[C@@H](CI)NC(=O)OCC1=CC=CC=C1 MCULE-8466951929 [0,1,0,0,0,0|2,0,1]=4 201 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-1594459503 [0,1,0,0,0,0|2,0,1]=4 202 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-2993382842 [0,1,0,0,0,0|2,0,1]=4 203 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-6244457893 [0,1,0,0,0,0|2,0,1]=4 204 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-7817877349 [0,1,0,0,0,0|2,0,1]=4 205 B15R1.741 C[C@@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-1166079257 [0,1,0,0,0,0|1,0,1]=3 206 B15R1.741 C[C@@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-7594665512 [0,1,0,0,0,0|1,0,1]=3 207 B15R1.741 C[C@H](CBr)NC(=O)OCC1=CC=CC=C1 MCULE-5068383734 [0,1,0,0,0,0|2,0,1]=4 208 B15R1.741 C[C@H](CI)NC(=O)OCC1=CC=CC=C1 MCULE-5791736283 [0,1,0,0,0,0|2,0,1]=4 209 B15R1.741 C[C@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-5101040671 [0,1,0,0,0,0|2,0,1]=4 210 B15R1.741 C[C@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-6949209988 [0,1,0,0,0,0|2,0,1]=4 211 B15R1.741 C[C@H](CN)NC(=O)OCC1=CC=CC=C1 MCULE-7528369674 [0,1,0,0,0,0|2,0,1]=4 212 B15R1.741 C[C@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-2003746861 [0,1,0,0,0,0|1,0,1]=3 213 B15R1.741 C[C@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-7292347023 [0,1,0,0,0,0|1,0,1]=3 214 B15R1.741 O=C(C[C@H](O)CO)NCC1=CC=CC=C1 MCULE-2767747247 [0,1,0,0,0,0|2,0,1]=4 215 B15R1.826 CN(CCBr)C(=O)OCC1=CC=CC=C1 MCULE-1969395988 [0,1,0,0,0,0|2,0,1]=4 216 B15R1.826 CN(CCN)C(=O)OCC1=CC=CC=C1 MCULE-4309855815 [0,1,0,0,0,0|2,0,1]=4 217 B15R1.826 CN(CCN)C(=O)OCC1=CC=CC=C1 MCULE-7633756358 [0,1,0,0,0,0|2,0,1]=4 218 B15R1.826 CN(CCO)C(=O)OCC1=CC=CC=C1 MCULE-6640361504 [0,1,0,0,0,0|1,0,1]=3 219 B15R1.826 N[C@@H](CCO)C(=O)OCC1=CC=CC=C1 MCULE-7311699890 [0,1,0,0,0,0|2,0,1]=4 220 B15R1.826 N[C@@H](CCO)C(=O)OCC1=CC=CC=C1 MCULE-9192479003 [0,1,0,0,0,0|2,0,1]=4 221 B15R1.1208 C=CCNC(=O)C=CC1=C(C=CC=C1)Cl MCULE-4886833640 [0,1,0,0,0,0|1,0,1]=3 222 B15R1.1208 CCCNC(=O)CCC1=C(C=CC=C1)Cl MCULE-3127323422 [0,1,0,0,0,0|1,0,2]=4 223 B15R1.1208 CCCNC(=O)CCC1=C(C=CC=C1)F MCULE-1405450219 [0,1,0,0,0,0|1,0,2]=4 224 B15R1.1208 CCCNC(=O)COC1=CC=CC=C1F MCULE-4764462457 [0,1,0,0,0,0|2,0,1]=4 225 B15R1.1208 CCCNC(=O)CSC1=CC=CC=C1N MCULE-5032568891 [0,1,0,0,0,0|2,0,1]=4 226 B15R1.1208 O=C(CCCO)NCC1=C(C=CC=C1)Cl MCULE-7153794950 [0,1,0,0,0,0|2,0,1]=4 227 B15R1.1208 O=C(COC1=C(C=CC=C1)Cl)NCCO MCULE-1214297645 [0,1,0,0,0,0|1,0,1]=3 228 B15R1.1208 O=C(COC1=C(C=CC=C1)O)OCCO MCULE-9678358670 [0,1,0,0,0,0|2,0,1]=4 229 B15R1.1208 O=C(COC1=CC=CC=C1Br)NCCO MCULE-6319354743 [0,1,0,0,0,0|1,0,1]=3 230 B15R1.5919 CC(C)CNC(=O)C=CC1=CC=CC=C1 MCULE-1510808399 [0,1,0,0,0,0|1,0,0]=2 231 B15R1.5919 CC(C)CNC(=O)CCC1=CC=CC=C1 MCULE-4400690471 [0,1,0,0,0,0|1,0,2]=4 232 B15R1.5919 CC(C)CNC(=O)COC1=CC=CC=C1 MCULE-1889335733 [0,1,0,0,0,0|2,0,1]=4 233 B15R1.5919 CC(C)CNC(=O)CSC1=CC=CC=C1 MCULE-6005269974 [0,1,0,0,0,0|2,0,1]=4 234 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 MCULE-6591216646 [0,1,0,0,0,0|2,0,0]=3 235 B15R1.5919 CC(N)CNC(=O)OCC1=CC=CC=C1 MCULE-7329655289 [0,1,0,0,0,0|2,0,1]=4 236 B15R1.5919 CC(N)CNC(=O)OCC1=CC=CC=C1 MCULE-9326022492 [0,1,0,0,0,0|2,0,1]=4 237 B15R1.5919 CC(O)CNC(=O)CCC1=CC=CC=C1 MCULE-9407755665 [0,1,0,0,0,0|0,0,2]=3 238 B15R1.5919 CC(O)CNC(=O)COC1=CC=CC=C1 MCULE-3210628170 [0,1,0,0,0,0|1,0,1]=3 239 B15R1.5919 CC(O)CNC(=O)CSC1=CC=CC=N1 MCULE-7129411317 [0,1,0,0,0,0|2,0,1]=4 240 B15R1.5919 CN(C)CCC(=O)/C=C/C1=CC=CC=C1 MCULE-1758251385 [0,1,0,0,0,0|3,0,0]=4 241 B15R1.5919 CN(C)CCC(=O)/C=C/C1=CC=CC=C1 MCULE-9618011686 [0,1,0,0,0,0|3,0,0]=4 242 B15R1.5919 CN(C)CCC(=O)C=CC1=CC=CC=C1 MCULE-1562405363 [0,1,0,0,0,0|3,0,0]=4 243 B15R1.5919 C[C@@H](N)CNC(=O)OCC1=CC=CC=C1 MCULE-4877774743 [0,1,0,0,0,0|2,0,1]=4 244 B15R1.5919 C[C@@H](N)CNC(=O)OCC1=CC=CC=C1 MCULE-5868702072 [0,1,0,0,0,0|2,0,1]=4 245 B15R1.5919 C[C@@H](O)CNC(=O)OCC1=CC=CC=C1 MCULE-2648888170 [0,1,0,0,0,0|1,0,1]=3 246 B15R1.5919 C[C@H](N)CNC(=O)OCC1=CC=CC=C1 MCULE-7773443565 [0,1,0,0,0,0|2,0,1]=4 247 B15R1.5919 C[C@H](N)CNC(=O)OCC1=CC=CC=C1 MCULE-8117857328 [0,1,0,0,0,0|2,0,1]=4 248 B15R1.5919 C[NH+](C)CCC(=O)C=CC1=CC=CC=C1 MCULE-3054063612 [0,1,0,0,0,0|3,0,0]=4 249 B15R1.5919 NC(=O)CNC(=O)C=CC1=CC=CC=C1 MCULE-4641590504 [0,1,0,0,0,0|0,0,2]=3 250 B15R1.5919 O=C(O)CCC(=O)/C=C/C1=CC=CC=C1 MCULE-8199334181 [0,1,0,0,0,0|1,0,1]=3 251 B15R1.5919 O=C(O)CCC(=O)C=CC1=CC=CC=C1 MCULE-4098020419 [0,1,0,0,0,0|1,0,1]=3 252 B15R1.5919 O=C(O)CNC(=O)/C=C/C1=CC=CC=C1 MCULE-4112484958 [0,1,0,0,0,0|0,0,1]=2 253 B15R1.5919 O=C(O)CNC(=O)C=CC1=CC=CC=C1 MCULE-8785925741 [0,1,0,0,0,0|0,0,1]=2 254 B15R1.5919 O=C(O)CNC(=O)CCC1=CC=CC=C1 MCULE-5429563264 [0,1,0,0,0,0|0,0,3]=4 255 B15R1.5919 O=C(O)CNC(=O)COC1=CC=CC=C1 MCULE-5895809378 [0,1,0,0,0,0|1,0,2]=4 256 B15R1.5919 O=C(O)CNC(=O)NCC1=CC=CC=C1 MCULE-3548003326 [0,1,0,0,0,0|1,0,2]=4 257 B15R1.5919 O=C(O)CNC(=O)OCC1=CC=CC=C1 MCULE-5138788160 [0,1,0,0,0,0|1,0,2]=4 258 B15R1.5919 O=C(O)CNC(=O)SCC1=CC=CC=C1 MCULE-9824846328 [0,1,0,0,0,0|1,0,2]=4 259 B15R1.5919 P(=O)(O)CNC(=O)OCC1=CC=CC=C1 MCULE-7721661253 [0,1,0,0,0,0|2,0,1]=4 260 B15R1.5934 CCCCS(=O)(=O)C=CC1=CC=CC=C1 MCULE-1338758209 [0,1,0,0,0,0|3,0,0]=4 261 B15R2.16 O=C1C=C(C(=CF)N1)C2=CC=CC=C2 MCULE-7370944053 [0,0,0,1,0,0|1,0,2]=4 262 B15R2.38 O=C1CCCCC1=CC2=CC=CC=C2 MCULE-1216184869 [0,0,0,1,0,0|2,0,0]=3 263 B15R2.38 O=C1CCSCC1=CC2=CC=CC=C2 MCULE-6898032457 [0,0,0,1,0,0|3,0,0]=4 264 B15R2.38 O=C1NCCCC1=CC2=CC=CC=C2 MCULE-6000001803 [0,0,0,1,0,0|1,0,0]=2 265 B15R2.38 O=C1NCCCN1CC2=CC=CC=C2 MCULE-8846054775 [0,0,0,1,0,0|2,0,1]=4 266 B15R2.38 O=C1NCCNC1CC2=CC=CC=C2 MCULE-1828026841 [0,0,0,1,0,0|1,0,2]=4 267 B15R2.38 O=C1NCCNC1CC2=CC=CC=C2 MCULE-5336210762 [0,0,0,1,0,0|1,0,2]=4 268 B15R2.38 O=C1NCCN[C@H]1CC2=CC=CC=C2 MCULE-1506547231 [0,0,0,1,0,0|1,0,2]=4 269 B15R2.38 O=C1NCCN[C@H]1CC2=CC=CC=C2 MCULE-2455418198 [0,0,0,1,0,0|1,0,2]=4 270 B15R2.38 O=C1NCCN[C@H]1CC2=CC=CC=C2 MCULE-7287439546 [0,0,0,1,0,0|1,0,2]=4 271 B15R2.38 O=C1NCCN[C@H]1CC2=CC=CC=C2 MCULE-9388493083 [0,0,0,1,0,0|1,0,2]=4 272 B15R2.38 O=C\1CCCC/C1=C\C2=CC=CC=C2 MCULE-7248069865 [0,0,0,1,0,0|2,0,0]=3 273 B15R2.352 BrCCOC1=CC2=C(C=CC=C2)C=C1 MCULE-8017419615 [0,0,0,1,0,0|3,0,0]=4 274 B15R2.352 CCCCC1=CC=C2C=CC=CC2=C1 MCULE-5002783646 [0,0,0,1,0,0|3,0,0]=4 275 B15R2.352 CCCOC1=CC2=C(C=CC=C2)C=C1 MCULE-1624753627 [0,0,0,1,0,0|3,0,0]=4 276 B15R2.352 CCCOC1=NC2=CC=CC=C2C=C1 MCULE-5019021394 [0,0,0,1,0,0|3,0,0]=4 277 B15R2.352 ClCCOC1=CC2=CC=CC=C2C=C1 MCULE-4933871406 [0,0,0,1,0,0|3,0,0]=4 278 B15R2.352 NCCCC1=CC2=CC=CC=C2C=C1 MCULE-6887508632 [0,0,0,1,0,0|3,0,0]=4 279 B15R2.352 NCCNC1=NC2=C(C=CC=C2)C=C1 MCULE-4667469881 [0,0,0,1,0,0|2,0,0]=3 280 B15R2.352 NCCNC1=NC2=C(C=CC=C2)C=C1 MCULE-6533048120 [0,0,0,1,0,0|2,0,0]=3 281 B15R2.352 NCCOC1=CC2=C(C=CC=C2)C=C1 MCULE-6411602521 [0,0,0,1,0,0|3,0,0]=4 282 B15R2.352 NCCOC1=CC2=CC=CC=C2C=C1 MCULE-4659358624 [0,0,0,1,0,0|3,0,0]=4 283 B15R2.352 OCCCC1=CC2=CC=CC=C2C=C1 MCULE-5500022518 [0,0,0,1,0,0|2,0,0]=3 284 B15R2.352 OCCCC1=NC2=C(C=CC=C2)C=C1 MCULE-9656983812 [0,0,0,1,0,0|2,0,0]=3 285 B15R2.352 OCCNC1=NC2=C(C=CC=C2)C=C1 MCULE-8905855832 [0,0,0,1,0,0|1,0,0]=2 286 B15R2.352 OCCNC1=NC2=C(C=CC=C2)N=C1 MCULE-1710010588 [0,0,0,1,0,0|2,0,0]=3 287 B15R2.352 OCCOC1=CC2=C(C=CC=C2)C=C1 MCULE-7641612768 [0,0,0,1,0,0|2,0,0]=3 288 B15R2.352 OCCOC1=NC2=C(C=CC=C2)N=C1 MCULE-2246121565 [0,0,0,1,0,0|3,0,0]=4 289 B15R2.352 SCCCC1=CC2=CC=CC=C2C=C1 MCULE-7003612282 [0,0,0,1,0,0|2,1,0]=4 290 B15R2.355 O=C1CNC(=O)C1=CC2=CC=CC=C2 MCULE-2447951601 [0,0,0,1,0,0|0,0,2]=3 291 B15R2.355 O=C1OCC(=C1CC2=CC=CC=C2)O MCULE-3834429291 [0,0,0,1,0,0|1,0,2]=4 292 B15R2.505 CC1CN1C(=O)OCC2=CC=CC=C2 MCULE-3834544016 [0,0,0,1,0,0|2,0,1]=4 293 B15R2.505 C[C@H]1CN1C(=O)OCC2=CC=CC=C2 MCULE-1946735882 [0,0,0,1,0,0|2,0,1]=4 294 B15R2.505 C[C@H]1CN1C(=O)OCC2=CC=CC=C2 MCULE-7732603226 [0,0,0,1,0,0|2,0,1]=4 295 B15R2.543 O=C1C=C(NCCN1)C2=CC=CC=C2 MCULE-7751153486 [0,0,0,1,0,0|1,0,0]=2 296 B15R2.543 O=C1CC(NCCN1)C2=CC=CC=C2 MCULE-6717848065 [0,0,0,1,0,0|1,0,2]=4 297 B15R2.9941 CCCN1C(=O)CNC2=C1C=CC=C2 MCULE-9636553539 [0,0,0,1,0,0|2,0,1]=4 298 B15R2.9941 CCCN1C(=O)COC2=C1C=CC=C2 MCULE-3373718730 [0,0,0,1,0,0|2,0,1]=4 299 B15R2.9941 NCCN1C(=O)CCC2=C1C=CC=C2 MCULE-3016103335 [0,0,0,1,0,0|1,0,2]=4 300 B15R2.9941 NCCN1C(=O)COC2=C1C=CC=C2 MCULE-8076996528 [0,0,0,1,0,0|2,0,1]=4 301 B15R2.9941 NCCN1C(=O)COC2=C1C=CC=C2 MCULE-8707280436 [0,0,0,1,0,0|2,0,1]=4 302 B15R2.9941 O=C1COC2=C(N1CCCl)C=CC=C2 MCULE-6438569423 [0,0,0,1,0,0|2,0,1]=4 303 B15R2.9941 O=C1COC2=C(N1CCO)C=CC=C2 MCULE-7026402315 [0,0,0,1,0,0|1,0,1]=3 304 B15R2.9941 O=C1NCC2=C(N1CCO)C=CC=C2 MCULE-4391886969 [0,0,0,1,0,0|1,0,1]=3 305 B15R2.24494 O=C(/C=C/C1=CC=CC=C1)NC2CC2 MCULE-5743873723 [0,0,0,1,0,0|1,0,0]=2 306 B15R2.24494 O=C(C=CC1=CC=CC=C1)NC2CC2 MCULE-4259167338 [0,0,0,1,0,0|1,0,0]=2 307 B15R2.24494 O=C(CCC1=CC=CC=C1)NC2CC2 MCULE-7161316491 [0,0,0,1,0,0|1,0,2]=4 308 B15R2.24494 O=C(COC1=CC=CC=C1)NC2CC2 MCULE-5656941678 [0,0,0,1,0,0|2,0,1]=4 309 B15R2.24494 O=C(CSC1=CC=CC=C1)NC2CC2 MCULE-4082071939 [0,0,0,1,0,0|2,0,1]=4 310 B15R2.24494 O=C(NC1CC1)OCC2=CC=CC=C2 MCULE-3399317577 [0,0,0,1,0,0|2,0,1]=4 311 B13R1.44 C#CCNC(=O)CC1=CC=CC=C1 MCULE-6252681137 [0,0,0,0,1,0|1,0,2]=4 312 B13R1.44 C#CCNC(=O)NC1=CC=CC=C1 MCULE-7077295972 [0,0,0,0,1,0|2,0,1]=4 313 B13R1.44 C=CCNC(=O)CC1=CC=CC=C1 MCULE-4243703425 [0,0,0,0,1,0|1,0,2]=4 314 B13R1.44 C=CCNC(=O)NC1=CC=CC=C1 MCULE-8335371773 [0,0,0,0,1,0|2,0,1]=4 315 B13R1.44 CCCCC(=O)CC1=CC=CC=C1 MCULE-3101369672 [0,0,0,0,1,0|2,0,1]=4 316 B13R1.44 CCCCC(=O)OC1=CC=CC=C1 MCULE-8399208696 [0,0,0,0,1,0|3,0,0]=4 317 B13R1.44 CCCNC(=O)NC1=CC=CC=C1 MCULE-9539768822 [0,0,0,0,1,0|2,0,0]=3 318 B13R1.44 CCCNC(=O)NC1=NC=CC=C1 MCULE-2743074333 [0,0,0,0,1,0|3,0,0]=4 319 B13R1.44 CCCNC(=S)NC1=CC=CC=C1 MCULE-1195138137 [0,0,0,0,1,0|2,1,0]=4 320 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 MCULE-6980766796 [0,0,0,0,1,0|2,0,1]=4 321 B13R1.44 CCONC(=O)NC1=CC=CC=C1 MCULE-2310954156 [0,0,0,0,1,0|3,0,0]=4 322 B13R1.44 N#CCNC(=O)CC1=CC=CC=C1 MCULE-2482334914 [0,0,0,0,1,0|1,0,2]=4 323 B13R1.44 NCCCC(=O)NC1=CC=CC=C1 MCULE-2415142400 [0,0,0,0,1,0|3,0,0]=4 324 B13R1.44 NCCCC(=O)NC1=CC=CC=C1 MCULE-6078665044 [0,0,0,0,1,0|3,0,0]=4 325 B13R1.44 NCCNC(=O)CC1=CC=CC=C1 MCULE-4086211834 [0,0,0,0,1,0|1,0,1]=3 326 B13R1.44 NCCNC(=O)NC1=CC=CC=C1 MCULE-2839960681 [0,0,0,0,1,0|2,0,0]=3 327 B13R1.44 NCCNC(=O)NC1=CC=CC=C1 MCULE-3425250766 [0,0,0,0,1,0|2,0,0]=3 328 B13R1.44 O=C(CC1=CC=CC=C1)NCCCl MCULE-6652712797 [0,0,0,0,1,0|1,0,1]=3 329 B13R1.44 O=C(CC1=CC=CC=C1)NCCO MCULE-5675818960 [0,0,0,0,1,0|0,0,1]=2 330 B13R1.44 O=C(CCCCl)NC1=CC=CC=C1 MCULE-2632144417 [0,0,0,0,1,0|3,0,0]=4 331 B13R1.44 O=C(NC1=CC=CC=C1)OCCBr MCULE-3869037982 [0,0,0,0,1,0|3,0,0]=4 332 B13R1.44 O=C(NC1=CC=CC=C1)OCCCl MCULE-2617106020 [0,0,0,0,1,0|3,0,0]=4 333 B13R1.44 O=C(NCCBr)NC1=CC=CC=C1 MCULE-3247495299 [0,0,0,0,1,0|2,0,0]=3 334 B13R1.44 O=C(NCCCl)NC1=CC=CC=C1 MCULE-9992215000 [0,0,0,0,1,0|2,0,0]=3 335 B13R1.44 O=C(NCCCl)NC1=CC=CN=C1 MCULE-9277097526 [0,0,0,0,1,0|3,0,0]=4 336 B13R1.44 O=C(NCCCl)NC1=CC=NC=C1 MCULE-1165280766 [0,0,0,0,1,0|3,0,0]=4 337 B13R1.44 O=C(NCCO)NC1=CC=CC=C1 MCULE-2961695079 [0,0,0,0,1,0|1,0,0]=2 338 B13R1.44 O=C(NCCO)OC1=CC=CC=C1 MCULE-3014990194 [0,0,0,0,1,0|1,0,0]=2 339 B13R1.44 OCC/N=C(\S)/NC1=CC=CC=C1 MCULE-4097032759 [0,0,0,0,1,0|1,1,1]=4 340 B13R1.44 S=C(NCCBr)NC1=CC=CC=C1 MCULE-8949826219 [0,0,0,0,1,0|2,1,0]=4 341 B15R1.157 CCCCC(=O)NN=CC1=CC=CC=C1 MCULE-8455044934 [0,0,0,0,0,1|3,0,0]=4 342 B15R1.157 CCCNC(=O)CCSC1=CC=CC=C1 MCULE-1716099079 [0,0,0,0,0,1|1,0,2]=4 343 B15R1.157 NCCNC(=O)CCCC1=CC=CC=C1 MCULE-5446592478 [0,0,0,0,0,1|1,0,2]=4 344 B15R1.157 NCCNC(=O)CCCC1=CC=CC=C1 MCULE-7809782143 [0,0,0,0,0,1|1,0,2]=4 345 B15R1.157 O=C(CCCO)NN=CC1=CC=CC=C1 MCULE-2095107213 [0,0,0,0,0,1|2,0,0]=3 346 B15R1.157 O=C(N/N=C/C1=CC=CC=C1)OCCO MCULE-6844104322 [0,0,0,0,0,1|2,0,0]=3 347 B15R1.157 OCCNC(=S)NCCC1=CC=CC=C1 MCULE-2645903834 [0,0,0,0,0,1|0,1,2]=4 348 B12R1.8 BrCCCC=CC1=CC=CC=C1 MCULE-2813492482 [2,0,0,0,0,0|1,0,1]=4 349 B12R1.8 CCCCC=CC1=CC=CC=C1 MCULE-3225443389 [2,0,0,0,0,0|1,0,1]=4 350 B12R1.8 CCNC/C=C/C1=CC=CC=C1 MCULE-5933439825 [2,0,0,0,0,0|0,0,1]=3 351 B12R1.8 CCNCC=CC1=CC=CC=C1 MCULE-2028860855 [2,0,0,0,0,0|0,0,1]=3 352 B12R1.8 CCNCC=CC1=CC=CC=C1 MCULE-5521996265 [2,0,0,0,0,0|0,0,1]=3 353 B12R1.8 OCCCC=CC1=CC=CC=C1 MCULE-9353464630 [2,0,0,0,0,0|0,0,1]=3 354 B12R1.8 OCCNCCC1=CC=CC=C1 MCULE-5313727578 [2,0,0,0,0,0|0,0,2]=4 355 B12R1.27 C/C(=N/O)/C=C/C1=CC=CC=C1 MCULE-1994376123 [2,0,0,0,0,0|1,0,1]=4 356 B12R1.27 CC(=NO)C=CC1=CC=CC=C1 MCULE-5760575133 [2,0,0,0,0,0|1,0,1]=4 357 B12R1.27 CCC(=O)C#CC1=CC=CC=C1 MCULE-2775139609 [2,0,0,0,0,0|0,0,2]=4 358 B12R1.27 CCC(=O)CCC1=CC=CC=C1 MCULE-8657578743 [2,0,0,0,0,0|0,0,2]=4 359 B12R1.27 CCC(=O)NCC1=CC=CC=C1 MCULE-7839045376 [2,0,0,0,0,0|1,0,1]=4 360 B12R1.27 CCC(=O)NNC1=CC=CC=C1 MCULE-1690055210 [2,0,0,0,0,0|2,0,0]=4 361 B12R1.27 CCC(=O)OCC1=CC=CC=C1 MCULE-6579799733 [2,0,0,0,0,0|1,0,1]=4 362 B12R1.27 CNC(=O)C=CC1=CC=CC=C1 MCULE-9520300155 [2,0,0,0,0,0|0,0,0]=2 363 B12R1.27 CNC(=O)CCC1=CC=CC=C1 MCULE-3807954819 [2,0,0,0,0,0|0,0,2]=4 364 B12R1.27 CNC(=O)COC1=CC=CC=C1 MCULE-3668298777 [2,0,0,0,0,0|1,0,1]=4 365 B12R1.27 CNC(C)C=CC1=CC=CC=C1 MCULE-8486679145 [2,0,0,0,0,0|1,0,1]=4 366 B12R1.27 COC(=O)/C=C/C1=CC=CC=C1 MCULE-2483911454 [2,0,0,0,0,0|1,0,0]=3 367 B12R1.27 COC(=O)/C=C/C1=CC=NC=C1 MCULE-6497290944 [2,0,0,0,0,0|2,0,0]=4 368 B12R1.27 COC(=O)/C=C/C1=CN=CC=C1 MCULE-5115987081 [2,0,0,0,0,0|2,0,0]=4 369 B12R1.27 COC(=O)C=CC1=CC=CC=C1 MCULE-1030097873 [2,0,0,0,0,0|1,0,0]=3 370 B12R1.27 COC(=O)C=CC1=CC=CN=C1 MCULE-1707015902 [2,0,0,0,0,0|2,0,0]=4 371 B12R1.27 COC(=O)C=CC1=CC=NC=C1 MCULE-9755170519 [2,0,0,0,0,0|2,0,0]=4 372 B12R1.27 COC(=O)C=CC1=NC=CC=C1 MCULE-9037911831 [2,0,0,0,0,0|2,0,0]=4 373 B12R1.27 N#CC(=O)/C=C/C1=CC=CC=C1 MCULE-3470946498 [2,0,0,0,0,0|1,0,1]=4 374 B12R1.27 NNC(=O)C=CC1=CC=CC=C1 MCULE-3366212941 [2,0,0,0,0,0|1,0,0]=3 375 B12R1.27 NNC(=O)C=CC1=CC=CN=C1 MCULE-9721752985 [2,0,0,0,0,0|2,0,0]=4 376 B12R1.27 O=C(C=CC1=CC=CC=C1)NO MCULE-6631204989 [2,0,0,0,0,0|0,0,0]=2 377 B12R1.27 O=C(CCC1=CC=CC=C1)NO MCULE-1964924561 [2,0,0,0,0,0|0,0,2]=4 378 B12R1.27 O=C(CO)NCC1=CC=CC=C1 MCULE-4708335371 [2,0,0,0,0,0|1,0,1]=4 379 B12R1.27 O=C(CO)OCC1=CC=CC=C1 MCULE-6868642200 [2,0,0,0,0,0|1,0,1]=4 380 B12R1.27 O=C(COC1=CC=CC=C1)NO MCULE-9180977721 [2,0,0,0,0,0|1,0,1]=4 381 B12R1.27 O=C(NO)NNC1=CC=CC=C1 MCULE-1384654171 [2,0,0,0,0,0|2,0,0]=4 382 B12R1.27 O=C(NO)OCC1=CC=CC=C1 MCULE-1476264710 [2,0,0,0,0,0|1,0,1]=4 383 B14R1.38 N#CCNC=CC(=O)C1=CC=CC=C1 MCULE-5739546402 [1,1,0,0,0,0|1,0,1]=4 384 B14R1.38 O=C(CCNCCO)C1=CC=CC=C1 MCULE-1088460684 [1,1,0,0,0,0|0,0,2]=4 385 B14R1.38 O=C(CCNCCO)C1=CC=CC=C1 MCULE-6460282554 [1,1,0,0,0,0|0,0,2]=4 386 B14R1.123 CCCCNC/C=C/C1=CC=CC=C1 MCULE-1473313057 [1,1,0,0,0,0|1,0,1]=4 387 B14R1.123 CCCCNC/C=C/C1=CC=CC=C1 MCULE-6970883370 [1,1,0,0,0,0|1,0,1]=4 388 B14R1.123 CCCCNCC=CC1=CC=CC=C1 MCULE-7722130839 [1,1,0,0,0,0|1,0,1]=4 389 B14R1.123 CCCCNCC=CC1=CC=CC=C1 MCULE-9292914221 [1,1,0,0,0,0|1,0,1]=4 390 B14R1.123 COCCNC/C=C/C1=CC=CC=C1 MCULE-2836896039 [1,1,0,0,0,0|0,0,1]=3 391 B14R1.123 COCCNC/C=C/C1=CC=CC=C1 MCULE-3327905799 [1,1,0,0,0,0|0,0,1]=3 392 B14R1.123 COCCNCC=CC1=CC=CC=C1 MCULE-1193065133 [1,1,0,0,0,0|0,0,1]=3 393 B14R1.123 COCCNCC=CC1=CC=CC=C1 MCULE-1809295368 [1,1,0,0,0,0|0,0,1]=3 394 B14R1.123 COCCNCC=CC1=CC=CC=C1 MCULE-2518619409 [1,1,0,0,0,0|0,0,1]=3 395 B14R1.123 OCCCNCC=CC1=CC=CC=C1 MCULE-1673600696 [1,1,0,0,0,0|0,0,1]=3 396 B14R1.123 OCCCNCC=CC1=CC=CC=C1 MCULE-9299231674 [1,1,0,0,0,0|0,0,1]=3 397 B14R1.158 CCCNCC(=CC1=CC=CC=C1)C MCULE-4605985100 [1,1,0,0,0,0|1,0,1]=4 398 B14R1.158 CCCNCC(=CC1=CC=CC=C1)C MCULE-4950204537 [1,1,0,0,0,0|1,0,1]=4 399 B14R1.158 O=C(CNCCO)NC1=CC=CC=C1 MCULE-3733627726 [1,1,0,0,0,0|1,0,1]=4 400 B14R1.422 CC(C)CNCC=CC1=CC=CC=C1 MCULE-2451637408 [1,1,0,0,0,0|1,0,1]=4 401 B14R1.422 CC(C)CNCC=CC1=CC=CC=C1 MCULE-5975547240 [1,1,0,0,0,0|1,0,1]=4 402 B14R1.422 O=C(O)CNCC=CC1=CC=CC=C1 MCULE-2348036420 [1,1,0,0,0,0|0,0,2]=4 403 B14R1.422 O=C(O)CNCC=CC1=CC=CC=C1 MCULE-7721479692 [1,1,0,0,0,0|0,0,2]=4 404 B14R1.716 CCC(C)NCC=CC1=CC=CC=C1 MCULE-2806161723 [1,1,0,0,0,0|1,0,1]=4 405 B14R1.716 CCC(C)NCC=CC1=CC=CC=C1 MCULE-5376485934 [1,1,0,0,0,0|1,0,1]=4 406 B14R1.29 CCNC(=CC(=O)C1=CC=CC=C1)C MCULE-8251132199 [1,1,0,0,0,0|1,0,0]=3 407 B14R1.29 CCNC(=O)CC(C)C1=CC=CC=C1 MCULE-3961081754 [1,1,0,0,0,0|0,0,2]=4 408 B14R1.29 CCNC(=S)NC(=O)C1=CC=CC=C1 MCULE-5571969744 [1,1,0,0,0,0|1,1,0]=4 409 B14R1.29 CCOC(=O)/C=C(\C)/C1=CC=CC=C1 MCULE-2903943612 [1,1,0,0,0,0|1,0,0]=3 410 B14R1.29 CCOC(=O)/C=C(\N)/C1=CC=CC=C1 MCULE-2460971973 [1,1,0,0,0,0|1,0,0]=3 411 B14R1.29 CCOC(=O)C=C(C)C1=CC=CC=C1 MCULE-1528367334 [1,1,0,0,0,0|1,0,0]=3 412 B14R1.29 CCOC(=O)C=C(N)C1=CC=CC=C1 MCULE-5451317548 [1,1,0,0,0,0|1,0,0]=3 413 B14R1.29 CCOC(=O)C=C(N)C1=NC=CC=C1 MCULE-8842688171 [1,1,0,0,0,0|2,0,0]=4 414 B14R1.29 CCOC(=O)C=C(S)C1=CC=CC=C1 MCULE-1460883477 [1,1,0,0,0,0|1,0,0]=3 415 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 MCULE-9444159278 [1,1,0,0,0,0|1,0,1]=4 416 B14R1.29 CCOC(=O)NC(=N)C1=CC=CC=C1 MCULE-3125407733 [1,1,0,0,0,0|2,0,0]=4 417 B14R1.32 CCNC(=O)/C=C/C1=CC(=CC=C1)Br MCULE-8787040575 [1,1,0,0,0,0|0,0,0]=2 418 B14R1.32 CCNC(=O)C=CC1=CC(=CC=C1)Br MCULE-5871406678 [1,1,0,0,0,0|0,0,0]=2 419 B14R1.32 CCNC(=O)CCC1=CC(=CC=C1)Br MCULE-2535387061 [1,1,0,0,0,0|0,0,2]=4 420 B14R1.32 CCNC(=O)COC1=CC(=CC=C1)Cl MCULE-5668948641 [1,1,0,0,0,0|1,0,1]=4 421 B14R1.32 CCNC(=O)COC1=CC(=CC=C1)N MCULE-4141979545 [1,1,0,0,0,0|1,0,1]=4 422 B14R1.32 CCNC(=O)COC1=CC=CC(=C1)O MCULE-8353110342 [1,1,0,0,0,0|1,0,1]=4 423 B14R1.32 CCOC(=O)/C=C/C1=CC(=CC=C1)F MCULE-6927875592 [1,1,0,0,0,0|1,0,0]=3 424 B14R1.32 CCOC(=O)/C=C/C1=CC(=CC=C1)O MCULE-5916017124 [1,1,0,0,0,0|1,0,0]=3 425 B14R1.32 CCOC(=O)/C=C/C1=CC(=NC=C1)Cl MCULE-1783555752 [1,1,0,0,0,0|2,0,0]=4 426 B14R1.32 CCOC(=O)/C=C/C1=CC=CC(=C1)Br MCULE-2598719375 [1,1,0,0,0,0|1,0,0]=3 427 B14R1.32 CCOC(=O)/C=C/C1=CC=CC(=C1)C MCULE-3542877003 [1,1,0,0,0,0|1,0,0]=3 428 B14R1.32 CCOC(=O)/C=C/C1=CC=CC(=C1)Cl MCULE-1108577307 [1,1,0,0,0,0|1,0,0]=3 429 B14R1.32 CCOC(=O)/C=C/C1=CC=CC(=C1)N MCULE-3539844964 [1,1,0,0,0,0|1,0,0]=3 430 B14R1.32 CCOC(=O)/C=C/C1=NC(=CC=C1)C MCULE-5942843116 [1,1,0,0,0,0|2,0,0]=4 431 B14R1.32 CCOC(=O)/C=C/C1=NC=CC(=C1)Br MCULE-8650584013 [1,1,0,0,0,0|2,0,0]=4 432 B14R1.32 CCOC(=O)C=CC1=CC(=CC=C1)O MCULE-1633691755 [1,1,0,0,0,0|1,0,0]=3 433 B14R1.32 CCOC(=O)C=CC1=CC(=NC=C1)Cl MCULE-5861862419 [1,1,0,0,0,0|2,0,0]=4 434 B14R1.32 CCOC(=O)C=CC1=CC=CC(=C1)Br MCULE-7329898396 [1,1,0,0,0,0|1,0,0]=3 435 B14R1.32 CCOC(=O)C=CC1=CC=CC(=C1)C MCULE-4834956528 [1,1,0,0,0,0|1,0,0]=3 436 B14R1.32 CCOC(=O)C=CC1=CC=CC(=C1)Cl MCULE-3764276694 [1,1,0,0,0,0|1,0,0]=3 437 B14R1.32 CCOC(=O)C=CC1=CC=CC(=C1)F MCULE-3869943309 [1,1,0,0,0,0|1,0,0]=3 438 B14R1.32 CCOC(=O)C=CC1=CC=CC(=C1)N MCULE-1798344522 [1,1,0,0,0,0|1,0,0]=3 439 B14R1.32 CCOC(=O)C=CC1=CC=CC(=N1)C MCULE-5632078733 [1,1,0,0,0,0|2,0,0]=4 440 B14R1.32 CCOC(=O)C=C[N+]1=CC(=CC=C1)C MCULE-1566289833 [1,1,0,0,0,0|2,0,0]=4 441 B14R1.32 CCOC(=O)C=C[N+]1=CC(=CC=C1)C MCULE-5376676357 [1,1,0,0,0,0|2,0,0]=4 442 B14R1.60 CCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-1950948076 [1,1,0,0,0,0|1,0,0]=3 443 B14R1.60 CCNC(=O)C(C)OC1=CC=CC=C1 MCULE-5775009487 [1,1,0,0,0,0|1,0,1]=4 444 B14R1.60 CCNC(=O)C(C)SC1=CC=CC=C1 MCULE-7817979109 [1,1,0,0,0,0|1,0,1]=4 445 B14R1.60 CCNC(=O)C(N)CC1=CC=CC=C1 MCULE-5389408970 [1,1,0,0,0,0|0,0,2]=4 446 B14R1.60 CCNC(=O)C(N)CC1=CC=CC=C1 MCULE-7432063617 [1,1,0,0,0,0|0,0,2]=4 447 B14R1.60 CCNC(=O)[C@@H](O)CC1=CC=CC=C1 MCULE-1200105776 [1,1,0,0,0,0|0,0,2]=4 448 B14R1.60 CCOC(=O)/C(=C/C1=CC=CC=C1)/Cl MCULE-6763986107 [1,1,0,0,0,0|1,0,0]=3 449 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 MCULE-9468209275 [1,1,0,0,0,0|1,0,1]=4 450 B14R1.60 CCOC(=O)C(=O)NC1=CC=CC=C1 MCULE-2208860355 [1,1,0,0,0,0|2,0,0]=4 451 B14R1.502 CCNC(=O)C=CC1=CC=C(C=C1)Br MCULE-7374097918 [1,1,0,0,0,0|0,0,0]=2 452 B14R1.502 CCNC(=O)C=CC1=CC=C(C=C1)F MCULE-2541115092 [1,1,0,0,0,0|0,0,0]=2 453 B14R1.502 CCNC(=O)CCC1=CC=C(C=C1)F MCULE-4315183093 [1,1,0,0,0,0|0,0,2]=4 454 B14R1.502 CCNC(=O)CCC1=CC=C(C=C1)I MCULE-1134499992 [1,1,0,0,0,0|0,0,2]=4 455 B14R1.502 CCNC(=O)COC1=CC=C(C=C1)C MCULE-7923498149 [1,1,0,0,0,0|1,0,1]=4 456 B14R1.502 CCNC(=O)COC1=CC=C(C=C1)F MCULE-3545787120 [1,1,0,0,0,0|1,0,1]=4 457 B14R1.502 CCNC(=O)COC1=CC=C(C=C1)I MCULE-6618128062 [1,1,0,0,0,0|1,0,1]=4 458 B14R1.502 CCNC(=O)COC1=CC=C(C=C1)N MCULE-8182711287 [1,1,0,0,0,0|1,0,1]=4 459 B14R1.502 CCNC(=O)CSC1=CC=C(C=C1)C MCULE-8312264713 [1,1,0,0,0,0|1,0,1]=4 460 B14R1.502 CCNC(=O)CSC1=CC=C(C=C1)Cl MCULE-9856346868 [1,1,0,0,0,0|1,0,1]=4 461 B14R1.502 CCNC(=O)NCC1=CC=C(C=C1)N MCULE-2544035306 [1,1,0,0,0,0|1,0,1]=4 462 B14R1.502 CCNC(=O)OCC1=CC=C(C=C1)Cl MCULE-8246390345 [1,1,0,0,0,0|1,0,1]=4 463 B14R1.502 CCNC(=O)OCC1=CC=C(C=C1)F MCULE-9997076844 [1,1,0,0,0,0|1,0,1]=4 464 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-1501717315 [1,1,0,0,0,0|1,0,0]=3 465 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)C MCULE-3171320196 [1,1,0,0,0,0|1,0,0]=3 466 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-7751863911 [1,1,0,0,0,0|1,0,0]=3 467 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)F MCULE-2927681987 [1,1,0,0,0,0|1,0,0]=3 468 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)N MCULE-2870787615 [1,1,0,0,0,0|1,0,0]=3 469 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)O MCULE-2249067422 [1,1,0,0,0,0|1,0,0]=3 470 B14R1.502 CCOC(=O)/C=C/C1=CC=C(N=C1)Br MCULE-9480752232 [1,1,0,0,0,0|2,0,0]=4 471 B14R1.502 CCOC(=O)/C=C/C1=CC=C(N=C1)Cl MCULE-8695208308 [1,1,0,0,0,0|2,0,0]=4 472 B14R1.502 CCOC(=O)/C=C/C1=CC=C(N=C1)N MCULE-1369434267 [1,1,0,0,0,0|2,0,0]=4 473 B14R1.502 CCOC(=O)/C=C/C1=NC=C(C=C1)C MCULE-1897813625 [1,1,0,0,0,0|2,0,0]=4 474 B14R1.502 CCOC(=O)/N=C/C1=CC=C(C=C1)Cl MCULE-5479736730 [1,1,0,0,0,0|2,0,0]=4 475 B14R1.502 CCOC(=O)/N=C/C1=CC=C(C=C1)F MCULE-7716522589 [1,1,0,0,0,0|2,0,0]=4 476 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)Br MCULE-5810276974 [1,1,0,0,0,0|1,0,0]=3 477 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)C MCULE-4978969608 [1,1,0,0,0,0|1,0,0]=3 478 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)Cl MCULE-7186331401 [1,1,0,0,0,0|1,0,0]=3 479 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)F MCULE-5671466981 [1,1,0,0,0,0|1,0,0]=3 480 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)N MCULE-5512198276 [1,1,0,0,0,0|1,0,0]=3 481 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)O MCULE-2959640396 [1,1,0,0,0,0|1,0,0]=3 482 B14R1.502 CCOC(=O)C=CC1=CC=C(N=C1)N MCULE-2950932126 [1,1,0,0,0,0|2,0,0]=4 483 B14R1.502 CCOC(=O)C=CC1=CN=C(C=C1)Br MCULE-8159900278 [1,1,0,0,0,0|2,0,0]=4 484 B14R1.502 CCOC(=O)C=CC1=CN=C(C=C1)Cl MCULE-7758315906 [1,1,0,0,0,0|2,0,0]=4 485 B14R1.502 CCOC(=O)C=CC1=NC=C(C=C1)C MCULE-2813187234 [1,1,0,0,0,0|2,0,0]=4 486 B14R1.502 CCOC(=O)C=NC1=CC=C(C=C1)Br MCULE-3041507938 [1,1,0,0,0,0|2,0,0]=4 487 B14R1.502 CCOC(=O)N=CC1=CC=C(C=C1)Cl MCULE-2872706993 [1,1,0,0,0,0|2,0,0]=4 488 B14R1.598 CCNC(=O)CCC1=C(C=CC=C1)Cl MCULE-2496204404 [1,1,0,0,0,0|0,0,2]=4 489 B14R1.598 CCNC(=O)CCC1=C(C=CC=C1)F MCULE-6042937793 [1,1,0,0,0,0|0,0,2]=4 490 B14R1.598 CCNC(=O)COC1=C(C=CC=C1)Cl MCULE-8441315595 [1,1,0,0,0,0|1,0,1]=4 491 B14R1.598 CCNC(=O)COC1=CC=CC=C1F MCULE-4909915311 [1,1,0,0,0,0|1,0,1]=4 492 B14R1.598 CCNC(=O)COC1=CC=CC=C1I MCULE-4802797616 [1,1,0,0,0,0|1,0,1]=4 493 B14R1.598 CCOC(=O)/C=C/C1=C(C=CC=C1)Cl MCULE-7848472676 [1,1,0,0,0,0|1,0,0]=3 494 B14R1.598 CCOC(=O)/C=C/C1=C(C=CC=C1)O MCULE-3540067788 [1,1,0,0,0,0|1,0,0]=3 495 B14R1.598 CCOC(=O)/C=C/C1=C(C=CN=C1)Cl MCULE-2846629911 [1,1,0,0,0,0|2,0,0]=4 496 B14R1.598 CCOC(=O)/C=C/C1=CC=CC=C1Br MCULE-5808661029 [1,1,0,0,0,0|1,0,0]=3 497 B14R1.598 CCOC(=O)/C=C/C1=CC=CC=C1C MCULE-4071567663 [1,1,0,0,0,0|1,0,0]=3 498 B14R1.598 CCOC(=O)/C=C/C1=CC=CC=C1F MCULE-6527399794 [1,1,0,0,0,0|1,0,0]=3 499 B14R1.598 CCOC(=O)/C=C/C1=CC=CC=C1I MCULE-4892394233 [1,1,0,0,0,0|1,0,0]=3 500 B14R1.598 CCOC(=O)/C=C/C1=CC=CC=C1N MCULE-7828211597 [1,1,0,0,0,0|1,0,0]=3 501 B14R1.598 CCOC(=O)/C=C/C1=CC=CN=C1Br MCULE-5881683324 [1,1,0,0,0,0|2,0,0]=4 502 B14R1.598 CCOC(=O)/C=C/C1=CC=CN=C1Cl MCULE-4215206077 [1,1,0,0,0,0|2,0,0]=4 503 B14R1.598 CCOC(=O)/C=C/C1=CC=CN=C1F MCULE-5513564432 [1,1,0,0,0,0|2,0,0]=4 504 B14R1.598 CCOC(=O)/C=C/C1=CC=NC=C1F MCULE-6308492485 [1,1,0,0,0,0|2,0,0]=4 505 B14R1.598 CCOC(=O)/C=C/C1=NC=CC=C1F MCULE-9597644622 [1,1,0,0,0,0|2,0,0]=4 506 B14R1.598 CCOC(=O)C=CC1=C(C=CC=C1)Br MCULE-3340563106 [1,1,0,0,0,0|1,0,0]=3 507 B14R1.598 CCOC(=O)C=CC1=C(C=CC=C1)Cl MCULE-6743553857 [1,1,0,0,0,0|1,0,0]=3 508 B14R1.598 CCOC(=O)C=CC1=C(C=CC=C1)F MCULE-6574858173 [1,1,0,0,0,0|1,0,0]=3 509 B14R1.598 CCOC(=O)C=CC1=C(C=CC=C1)O MCULE-9512029862 [1,1,0,0,0,0|1,0,0]=3 510 B14R1.598 CCOC(=O)C=CC1=C(C=CC=N1)F MCULE-7207746112 [1,1,0,0,0,0|2,0,0]=4 511 B14R1.598 CCOC(=O)C=CC1=C(N=CC=C1)Cl MCULE-4671836289 [1,1,0,0,0,0|2,0,0]=4 512 B14R1.598 CCOC(=O)C=CC1=C(N=CC=C1)N MCULE-2242288328 [1,1,0,0,0,0|2,0,0]=4 513 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1N MCULE-4484504068 [1,1,0,0,0,0|1,0,0]=3 514 B14R1.598 CCOC(=O)C=CC1=CC=CN=C1Br MCULE-1945541172 [1,1,0,0,0,0|2,0,0]=4 515 B14R1.598 CCOC(=O)C=CC1=CC=CN=C1F MCULE-5996747012 [1,1,0,0,0,0|2,0,0]=4 516 B14R1.598 CCOC(=O)C=CC1=CN=CC=C1N MCULE-9365428640 [1,1,0,0,0,0|2,0,0]=4 517 B14R1.756 CN(CO)C(=O)C=CC1=CC=CC=C1 MCULE-2306220141 [1,1,0,0,0,0|0,0,0]=2 518 B14R1.756 COC(=O)C(=O)/C=C/C1=CC=CC=C1 MCULE-4810975389 [1,1,0,0,0,0|2,0,0]=4 519 B14R1.756 COC(=O)C(=O)C=CC1=CC=CC=C1 MCULE-5484407357 [1,1,0,0,0,0|2,0,0]=4 520 B14R1.756 CON(C)C(=O)C=CC1=CC=CC=C1 MCULE-8680806908 [1,1,0,0,0,0|1,0,0]=3 521 B14R1.756 NC(CO)C(=O)OCC1=CC=CC=C1 MCULE-2883827674 [1,1,0,0,0,0|1,0,1]=4 522 B14R1.756 NC(CO)C(=O)OCC1=CC=CC=C1 MCULE-4564909537 [1,1,0,0,0,0|1,0,1]=4 523 B14R1.756 NC(CO)C(=O)OCC1=CC=CC=C1 MCULE-5827084591 [1,1,0,0,0,0|1,0,1]=4 524 B14R1.756 NC(CO)C(=O)OCC1=CC=CC=C1 MCULE-6484959215 [1,1,0,0,0,0|1,0,1]=4 525 B14R1.756 NC(CO)C(=O)OCC1=CC=CC=C1 MCULE-7222164191 [1,1,0,0,0,0|1,0,1]=4 526 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-2844633748 [1,1,0,0,0,0|1,0,1]=4 527 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-5022315026 [1,1,0,0,0,0|1,0,1]=4 528 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-6180058335 [1,1,0,0,0,0|1,0,1]=4 529 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-8299962419 [1,1,0,0,0,0|1,0,1]=4 530 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-8647273184 [1,1,0,0,0,0|1,0,1]=4 531 B14R1.756 N[C@H](CO)C(=O)NCC1=CC=CC=C1 MCULE-9856146385 [1,1,0,0,0,0|1,0,1]=4 532 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-1169518419 [1,1,0,0,0,0|1,0,1]=4 533 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-1795934540 [1,1,0,0,0,0|1,0,1]=4 534 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-1924864389 [1,1,0,0,0,0|1,0,1]=4 535 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 MCULE-8305546830 [1,1,0,0,0,0|1,0,1]=4 536 B14R1.756 O=C(OCC1=CC=CC=C1)C(O)CO MCULE-9304283856 [1,1,0,0,0,0|1,0,1]=4 537 B14R1.756 [NH3+]C(CO)C(=O)OCC1=CC=CC=C1 MCULE-9620646817 [1,1,0,0,0,0|1,0,1]=4 538 B14R1.818 CC(=O)CC(=O)C=CC1=CC=CC=C1 MCULE-3696385223 [1,1,0,0,0,0|0,0,2]=4 539 B14R1.818 CC(C)CC(=O)C=CC1=CC=CC=C1 MCULE-9371637544 [1,1,0,0,0,0|1,0,0]=3 540 B14R1.818 CC(C)NC(=O)C=CC1=CC=CC=C1 MCULE-2840104417 [1,1,0,0,0,0|0,0,0]=2 541 B14R1.818 CC(C)NC(=O)CCC1=CC=CC=C1 MCULE-6879204729 [1,1,0,0,0,0|0,0,2]=4 542 B14R1.818 CC(C)OC(=O)/C=C/C1=CC=CC=C1 MCULE-7080708859 [1,1,0,0,0,0|1,0,0]=3 543 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 MCULE-3604470298 [1,1,0,0,0,0|1,0,0]=3 544 B14R1.818 CN(C)NC(=O)C=CC1=CC=CC=C1 MCULE-3157533941 [1,1,0,0,0,0|1,0,0]=3 545 B14R1.818 NC(=S)NC(=O)C=CC1=CC=CC=C1 MCULE-6921430293 [1,1,0,0,0,0|0,1,1]=4 546 B14R1.6829 CCOS(=O)(=O)C=CC1=CC=CC=C1 MCULE-3644145907 [1,1,0,0,0,0|2,0,0]=4 547 B14R1.6829 CONS(=O)(=O)C=CC1=CC=CC=C1 MCULE-5288573227 [1,1,0,0,0,0|2,0,0]=4 548 B14R1.33 CC1=CC=C(C=C1)NC(=O)NCCBr MCULE-1015689197 [0,1,0,0,1,0|2,0,0]=4 549 B14R1.33 CC1=CC=C(C=C1)NC(=S)NCCO MCULE-9938055393 [0,1,0,0,1,0|1,1,0]=4 550 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)Br MCULE-9530103042 [0,1,0,0,1,0|1,0,1]=4 551 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)C MCULE-3783716447 [0,1,0,0,1,0|1,0,1]=4 552 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)F MCULE-9330542747 [0,1,0,0,1,0|1,0,1]=4 553 B14R1.33 CCCNC(=O)NC1=CC=C(C=C1)Br MCULE-6484079372 [0,1,0,0,1,0|2,0,0]=4 554 B14R1.33 CCCNC(=O)NC1=CC=C(C=C1)Cl MCULE-2396125899 [0,1,0,0,1,0|2,0,0]=4 555 B14R1.33 CCCNC(=O)SC1=CC=C(C=C1)Cl MCULE-8745018557 [0,1,0,0,1,0|2,0,0]=4 556 B14R1.33 NC1=CC=C(C=C1)CC(=O)NCCO MCULE-6680763446 [0,1,0,0,1,0|0,0,1]=3 557 B14R1.33 NC1=CC=C(C=C1)CC(=O)NCCO MCULE-7792677656 [0,1,0,0,1,0|0,0,1]=3 558 B14R1.33 NCCNC(=O)CC1=CC=C(C=C1)F MCULE-3301429644 [0,1,0,0,1,0|1,0,1]=4 559 B14R1.33 NCCNC(=O)CC1=CC=C(C=C1)F MCULE-7797954326 [0,1,0,0,1,0|1,0,1]=4 560 B14R1.33 NCCNC(=O)NC1=CC=C(C=C1)Br MCULE-2016325439 [0,1,0,0,1,0|2,0,0]=4 561 B14R1.33 NCCNC(=O)NC1=CC=C(C=C1)Br MCULE-5808894361 [0,1,0,0,1,0|2,0,0]=4 562 B14R1.33 NCCNC(=O)NC1=CC=C(C=C1)F MCULE-2867845636 [0,1,0,0,1,0|2,0,0]=4 563 B14R1.33 NCCNC(=O)NC1=CC=C(C=C1)F MCULE-5812846742 [0,1,0,0,1,0|2,0,0]=4 564 B14R1.33 O=C(CC1=CC=C(C=C1)O)NCCO MCULE-7241177592 [0,1,0,0,1,0|0,0,1]=3 565 B14R1.33 O=C(NCCBr)NC1=CC=C(C=C1)Cl MCULE-2004937031 [0,1,0,0,1,0|2,0,0]=4 566 B14R1.33 O=C(NCCBr)NC1=CC=C(C=C1)F MCULE-1078096668 [0,1,0,0,1,0|2,0,0]=4 567 B14R1.33 O=C(NCCCl)NC1=CC=C(C=C1)Br MCULE-8265570757 [0,1,0,0,1,0|2,0,0]=4 568 B14R1.33 O=C(NCCCl)NC1=CC=C(C=C1)F MCULE-8788605119 [0,1,0,0,1,0|2,0,0]=4 569 B14R1.33 O=C(NCCO)NC1=CC=C(C=C1)Cl MCULE-7182335618 [0,1,0,0,1,0|1,0,0]=3 570 B14R1.33 OCCN/C(=N/C1=CC=C(C=C1)Cl)/S MCULE-5644274524 [0,1,0,0,1,0|1,1,0]=4 571 B14R1.33 OCCNC(=S)NC1=CC=C(C=C1)Br MCULE-1975893942 [0,1,0,0,1,0|1,1,0]=4 572 B14R1.33 OCCNC(=S)NC1=CC=C(C=C1)F MCULE-2577306345 [0,1,0,0,1,0|1,1,0]=4 573 B14R1.33 OCCNC(=S)NC1=CC=C(C=C1)I MCULE-7992188033 [0,1,0,0,1,0|1,1,0]=4 574 B14R1.34 CC1=CC(=CC=C1)NC(=O)NCCN MCULE-2888089475 [0,1,0,0,1,0|2,0,0]=4 575 B14R1.34 CC1=CC(=CC=C1)NC(=O)NCCO MCULE-7975628706 [0,1,0,0,1,0|1,0,0]=3 576 B14R1.34 CC1=CC=CC(=C1)NC(=O)NCCN MCULE-4595585856 [0,1,0,0,1,0|2,0,0]=4 577 B14R1.34 CC1=CC=CC(=C1)NC(=S)NCCO MCULE-2922305265 [0,1,0,0,1,0|1,1,0]=4 578 B14R1.34 CCCNC(=O)NC1=CC(=CC=C1)C MCULE-2098630012 [0,1,0,0,1,0|2,0,0]=4 579 B14R1.34 CCCNC(=O)NC1=CC(=CC=C1)O MCULE-4598853011 [0,1,0,0,1,0|2,0,0]=4 580 B14R1.34 CCCNC(=O)OC1=CC=CC(=C1)C MCULE-7587799833 [0,1,0,0,1,0|2,0,0]=4 581 B14R1.34 NCCNC(=O)CC1=CC(=CC=C1)F MCULE-5986552993 [0,1,0,0,1,0|1,0,1]=4 582 B14R1.34 NCCNC(=O)NC1=CC(=CC=C1)Br MCULE-6627083696 [0,1,0,0,1,0|2,0,0]=4 583 B14R1.34 NCCNC(=O)NC1=CC(=CC=C1)Cl MCULE-5315161173 [0,1,0,0,1,0|2,0,0]=4 584 B14R1.34 NCCNC(=O)NC1=CC(=CC=C1)F MCULE-6874236937 [0,1,0,0,1,0|2,0,0]=4 585 B14R1.34 NCCNC(=O)NC1=CC=CC(=C1)Br MCULE-1000489294 [0,1,0,0,1,0|2,0,0]=4 586 B14R1.34 NCCNC(=O)NC1=CC=CC(=C1)Cl MCULE-6135734553 [0,1,0,0,1,0|2,0,0]=4 587 B14R1.34 NCCNC(=O)NC1=CC=CC(=C1)F MCULE-3541649283 [0,1,0,0,1,0|2,0,0]=4 588 B14R1.34 O=C(NCCBr)NC1=CC=CC(=C1)Cl MCULE-6213373865 [0,1,0,0,1,0|2,0,0]=4 589 B14R1.34 O=C(NCCCl)NC1=CC(=CC=C1)F MCULE-9018176350 [0,1,0,0,1,0|2,0,0]=4 590 B14R1.34 O=C(NCCCl)NC1=CC=CC(=C1)Br MCULE-7673514406 [0,1,0,0,1,0|2,0,0]=4 591 B14R1.34 O=C(NCCO)NC1=CC(=CC=C1)Cl MCULE-1959400403 [0,1,0,0,1,0|1,0,0]=3 592 B14R1.34 OCCNC(=S)NC1=CC(=CC=C1)Cl MCULE-7276548241 [0,1,0,0,1,0|1,1,0]=4 593 B14R1.34 OCCNC(=S)NC1=CC(=CC=C1)F MCULE-9535412487 [0,1,0,0,1,0|1,1,0]=4 594 B14R1.166 O=C(NCCO)C(O)C1=CC=CC=C1 MCULE-9006098957 [0,1,0,0,1,0|0,0,1]=3 595 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 MCULE-7095510227 [0,1,0,0,1,0|1,0,1]=4 596 B14R1.423 CC(C)CNC(=O)NC1=CC=CC=C1 MCULE-4809649587 [0,1,0,0,1,0|2,0,0]=4 597 B14R1.423 CC(C)CNC(=O)OC1=CC=CC=C1 MCULE-9594855698 [0,1,0,0,1,0|2,0,0]=4 598 B14R1.423 CC(O)CNC(=S)NC1=CC=CC=C1 MCULE-3515969846 [0,1,0,0,1,0|1,1,0]=4 599 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 MCULE-5745004562 [0,1,0,0,1,0|0,0,2]=4 600 B14R1.423 O=C(O)CNC(=O)NC1=CC=CC=C1 MCULE-5518652665 [0,1,0,0,1,0|1,0,1]=4 601 B14R1.423 O=C(O)CNC(=O)OC1=CC=CC=C1 MCULE-7176970550 [0,1,0,0,1,0|1,0,1]=4 602 B14R1.467 CCCCC(=CC1=CC=CC=C1)C=O MCULE-4768541536 [0,1,0,0,1,0|2,0,0]=4 603 B14R1.946 CC1=C(C=CC=C1)NC(=O)NCCN MCULE-8712639844 [0,1,0,0,1,0|2,0,0]=4 604 B14R1.946 CC1=CC=CC=C1CC(=O)NCCO MCULE-8871213535 [0,1,0,0,1,0|0,0,1]=3 605 B14R1.946 CC1=CC=CC=C1NC(=O)NCCN MCULE-3909802942 [0,1,0,0,1,0|2,0,0]=4 606 B14R1.946 CC1=CC=CC=C1NC(=S)NCCO MCULE-3302556788 [0,1,0,0,1,0|1,1,0]=4 607 B14R1.946 CCCNC(=O)NC1=C(C=CC=C1)C MCULE-4272031642 [0,1,0,0,1,0|2,0,0]=4 608 B14R1.946 CCCNC(=O)NC1=CC=CC=C1Cl MCULE-9203378911 [0,1,0,0,1,0|2,0,0]=4 609 B14R1.946 CCCNC(=O)NC1=CC=CC=C1I MCULE-5704221888 [0,1,0,0,1,0|2,0,0]=4 610 B14R1.946 NCCNC(=O)NC1=C(C=CC=C1)Br MCULE-1045524308 [0,1,0,0,1,0|2,0,0]=4 611 B14R1.946 NCCNC(=O)NC1=C(C=CC=C1)Cl MCULE-2564739997 [0,1,0,0,1,0|2,0,0]=4 612 B14R1.946 NCCNC(=O)NC1=C(C=CC=C1)Cl MCULE-6195958213 [0,1,0,0,1,0|2,0,0]=4 613 B14R1.946 NCCNC(=O)NC1=CC=CC=C1Br MCULE-9521525950 [0,1,0,0,1,0|2,0,0]=4 614 B14R1.946 O=C(CC1=CC=CC=C1Br)NCCCl MCULE-9165088720 [0,1,0,0,1,0|1,0,1]=4 615 B14R1.946 O=C(CC1=CC=CC=C1Br)NCCO MCULE-9398115647 [0,1,0,0,1,0|0,0,1]=3 616 B14R1.946 O=C(NCCBr)NC1=CC=CC=C1F MCULE-3450240975 [0,1,0,0,1,0|2,0,0]=4 617 B14R1.946 O=C(NCCCl)NC1=CC=CC=C1Cl MCULE-2633130337 [0,1,0,0,1,0|2,0,0]=4 618 B14R1.946 O=C(NCCO)NC1=C(C=CC=C1)Cl MCULE-7529106664 [0,1,0,0,1,0|1,0,0]=3 619 B14R1.946 OCCNC(=S)NC1=CC=CC=C1Cl MCULE-9596018015 [0,1,0,0,1,0|1,1,0]=4 620 B14R1.946 OCCNC(=S)NC1=CC=CC=C1F MCULE-6503075081 [0,1,0,0,1,0|1,1,0]=4 621 B14R1.86 CCCCNC(=O)C=CC1=CC=CS1 MCULE-1357910038 [0,1,0,0,1,0|2,0,0]=4 622 B14R1.86 COCCNC(=O)C=CC1=CC=CS1 MCULE-6015849992 [0,1,0,0,1,0|1,0,0]=3 623 B14R1.588 CCC(C)NC(=O)C=CC1=CC=CO1 MCULE-3732657420 [0,1,0,0,1,0|2,0,0]=4 624 B14R1.4526 CC(C)CNC(=O)C=CC1=CC=CO1 MCULE-4939918074 [0,1,0,0,1,0|2,0,0]=4 625 B14R1.4526 CC(C)CNC(=O)C=CC1=CC=CS1 MCULE-2662536578 [0,1,0,0,1,0|2,0,0]=4 626 B14R1.4526 O=C(O)CNC(=O)C=CC1=CC=CO1 MCULE-1683379489 [0,1,0,0,1,0|1,0,1]=4 627 B14R1.4526 O=C(O)CNC(=O)C=CC1=CC=CS1 MCULE-1239984615 [0,1,0,0,1,0|1,0,1]=4 628 B16R1.8 O=C(CCCO)NN=CC1=CC=C(C=C1)Cl MCULE-8803166274 [0,1,0,0,0,1|2,0,0]=4 629 B16R1.8 O=C(CCCO)NN=CC1=CC=C(C=C1)F MCULE-7524410476 [0,1,0,0,0,1|2,0,0]=4 630 B16R1.8 O=C(CCCO)NN=CC1=CC=C(C=C1)O MCULE-1942646523 [0,1,0,0,0,1|2,0,0]=4 631 B16R1.119 O=C(CCCO)NN=CC1=CC=CC(=C1)Br MCULE-9415275658 [0,1,0,0,0,1|2,0,0]=4 632 B16R1.700 CC(=NNC(=S)NCCO)C1=CC=CC=C1 MCULE-3546688976 [0,1,0,0,0,1|1,1,0]=4 633 B16R1.700 O=C(CNC(=O)C1=CC=CC=C1)NCCO MCULE-7165021631 [0,1,0,0,0,1|0,0,1]=3 634 B16R1.1516 CCCNC(=O)C(=O)NCC1=CC=CC=C1 MCULE-9684051175 [0,1,0,0,0,1|1,0,1]=4 635 B16R1.1516 O=C(NCCO)C(=O)NCC1=CC=CC=C1 MCULE-1996465104 [0,1,0,0,0,1|0,0,1]=3 636 B16R1.1516 O=C(NCCO)C(=O)NCC1=CC=NC=C1 MCULE-9168711934 [0,1,0,0,0,1|1,0,1]=4 637 B16R1.1516 O=C(NCCO)C(=O)NCC1=CN=CC=C1 MCULE-6091919711 [0,1,0,0,0,1|1,0,1]=4 638 B16R1.1516 O=C(NCCO)C(=O)NCC1=NC=CC=C1 MCULE-4585014169 [0,1,0,0,0,1|1,0,1]=4 639 B16R1.1694 COCCNC(=O)CCCC1=CC=CC=C1 MCULE-3657806504 [0,1,0,0,0,1|0,0,2]=4 640 B16R1.1694 COCCNC(=O)CCSC1=CC=CC=C1 MCULE-4075334609 [0,1,0,0,0,1|0,0,2]=4 641 B16R1.1694 O=C(COCC1=CC=CC=C1)NCCCO MCULE-8492800331 [0,1,0,0,0,1|0,0,2]=4 642 B16R1.4473 O=C(CCCO)NN=CC1=CC=CC=C1O MCULE-5273701837 [0,1,0,0,0,1|2,0,0]=4 643 B16R1.18213 CC(O)CCC(=O)NN=CC1=CC=CC=C1 MCULE-5397882253 [0,1,0,0,0,1|2,0,0]=4 644 B16R1.35 COCCNC(=S)NC(=O)C1=CC=CC=C1 MCULE-8051690580 [0,2,0,0,0,0|1,1,0]=4 645 B16R1.51 COCCNC(=O)C=CC1=CC=C(C=C1)Br MCULE-2767493418 [0,2,0,0,0,0|0,0,0]=2 646 B16R1.51 COCCNC(=O)C=CC1=CC=C(C=C1)C MCULE-3967471456 [0,2,0,0,0,0|0,0,0]=2 647 B16R1.51 COCCNC(=O)C=CC1=CC=C(C=C1)Cl MCULE-1094554125 [0,2,0,0,0,0|0,0,0]=2 648 B16R1.51 COCCNC(=O)COC1=CC=C(C=C1)Br MCULE-7796136919 [0,2,0,0,0,0|1,0,1]=4 649 B16R1.51 COCCNC(=O)COC1=CC=C(C=C1)C MCULE-5208635841 [0,2,0,0,0,0|1,0,1]=4 650 B16R1.51 COCCNC(=O)COC1=CC=C(C=C1)Cl MCULE-3581252869 [0,2,0,0,0,0|1,0,1]=4 651 B16R1.51 COCCNC(=O)COC1=CC=C(C=C1)F MCULE-1869507479 [0,2,0,0,0,0|1,0,1]=4 652 B16R1.51 COCCNC(=O)CSC1=CC=C(C=C1)C MCULE-1169111420 [0,2,0,0,0,0|1,0,1]=4 653 B16R1.51 COCCNC(=O)CSC1=CC=C(C=C1)Cl MCULE-8311342398 [0,2,0,0,0,0|1,0,1]=4 654 B16R1.51 COCCNC(=O)NCC1=CC=C(C=C1)F MCULE-8083173509 [0,2,0,0,0,0|1,0,1]=4 655 B16R1.52 COCCNC(=O)C=CC1=CC=CC(=C1)Cl MCULE-5905108637 [0,2,0,0,0,0|0,0,0]=2 656 B16R1.52 COCCNC(=O)COC1=CC(=CC=C1)Br MCULE-4821312750 [0,2,0,0,0,0|1,0,1]=4 657 B16R1.52 COCCNC(=O)COC1=CC(=CC=C1)C MCULE-4911879350 [0,2,0,0,0,0|1,0,1]=4 658 B16R1.52 COCCNC(=O)COC1=CC=CC(=C1)Cl MCULE-4937488625 [0,2,0,0,0,0|1,0,1]=4 659 B16R1.608 CC(C)CCNC(=O)C=CC1=CC=CC=C1 MCULE-9993381284 [0,2,0,0,0,0|1,0,0]=3 660 B16R1.608 CC(C)CCOC(=O)C=CC1=CC=CC=C1 MCULE-8439563922 [0,2,0,0,0,0|2,0,0]=4 661 B16R1.608 CC(O)CCNC(=O)OCC1=CC=CC=C1 MCULE-4453250330 [0,2,0,0,0,0|1,0,1]=4 662 B16R1.608 CN(C)CCOC(=O)C=CC1=CC=CC=C1 MCULE-6159745106 [0,2,0,0,0,0|2,0,0]=4 663 B16R1.608 C[NH+](C)CCOC(=O)C=CC1=CC=CC=C1 MCULE-1059262545 [0,2,0,0,0,0|2,0,0]=4 664 B16R1.608 O=C(NCCB(O)O)OCC1=CC=CC=C1 MCULE-5170391030 [0,2,0,0,0,0|1,0,1]=4 665 B16R1.608 O=C(O)CCNC(=O)C=CC1=CC=CC=C1 MCULE-5576632337 [0,2,0,0,0,0|0,0,0]=2 666 B16R1.608 O=C(O)CCNC(=O)COC1=CC=CC=C1 MCULE-4619290652 [0,2,0,0,0,0|1,0,1]=4 667 B16R1.608 O=C(O)CCNC(=O)NCC1=CC=CC=C1 MCULE-8566019003 [0,2,0,0,0,0|1,0,1]=4 668 B16R1.608 O=C(O)CCNC(=O)OCC1=CC=CC=C1 MCULE-6298733130 [0,2,0,0,0,0|1,0,1]=4 669 B16R1.688 CCCCCNC(=O)C=CC1=CC=CC=C1 MCULE-6817461754 [0,2,0,0,0,0|1,0,0]=3 670 B16R1.688 COCCCNC(=O)C=CC1=CC=CC=C1 MCULE-9577417328 [0,2,0,0,0,0|0,0,0]=2 671 B16R1.688 COCCCNC(=O)CCC1=CC=CC=C1 MCULE-8766577728 [0,2,0,0,0,0|0,0,2]=4 672 B16R1.688 COCCCNC(=O)COC1=CC=CC=C1 MCULE-8586543950 [0,2,0,0,0,0|1,0,1]=4 673 B16R1.688 COCCCNC(=O)CSC1=CC=CC=C1 MCULE-4118941065 [0,2,0,0,0,0|1,0,1]=4 674 B16R1.688 NOCCCNC(=O)OCC1=CC=CC=C1 MCULE-4491362911 [0,2,0,0,0,0|1,0,1]=4 675 B16R1.688 NOCCCNC(=O)OCC1=CC=CC=C1 MCULE-7536002479 [0,2,0,0,0,0|1,0,1]=4 676 B16R1.688 O=C(C=CC1=CC=CC=C1)OCCCCCl MCULE-7796465649 [0,2,0,0,0,0|2,0,0]=4 677 B16R1.688 O=C(NCCCCO)OCC1=CC=CC=C1 MCULE-4529520871 [0,2,0,0,0,0|1,0,1]=4 678 B16R1.1216 CCCCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-7302639275 [0,2,0,0,0,0|2,0,0]=4 679 B16R1.1216 COCCNC(=O)C(=CC1=CC=CC=C1)C MCULE-4447487353 [0,2,0,0,0,0|0,0,0]=2 680 B16R1.1216 COCCNC(=O)C(=O)NC1=CC=CC=C1 MCULE-5965601727 [0,2,0,0,0,0|1,0,0]=3 681 B16R1.1216 COCCNC(=O)C(C)OC1=CC=CC=C1 MCULE-4057863368 [0,2,0,0,0,0|1,0,1]=4 682 B16R1.1216 COCCNC(=O)C(N)CC1=CC=CC=C1 MCULE-1151974853 [0,2,0,0,0,0|0,0,2]=4 683 B16R1.1216 COCCNC(=O)C(N)CC1=CC=CC=C1 MCULE-3818967242 [0,2,0,0,0,0|0,0,2]=4 684 B16R1.1216 COCCNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-3201676952 [0,2,0,0,0,0|0,0,2]=4 685 B16R1.1216 NC(CC1=CC=CC=C1)C(=O)NCCCO MCULE-3489818675 [0,2,0,0,0,0|0,0,2]=4 686 B16R1.1216 NC(CC1=CC=CC=C1)C(=O)NCCCO MCULE-9938902168 [0,2,0,0,0,0|0,0,2]=4 687 B16R1.1216 O=C(NCCCO)C(=O)NC1=CC=CC=C1 MCULE-5966070156 [0,2,0,0,0,0|1,0,0]=3 688 B16R1.1216 O=C(NCCCO)C(=O)NC1=CC=NC=C1 MCULE-4016643199 [0,2,0,0,0,0|2,0,0]=4 689 B16R1.1343 CC(CO)CNC(=O)OCC1=CC=CC=C1 MCULE-4711594684 [0,2,0,0,0,0|1,0,1]=4 690 B16R1.1343 COC(=O)CNC(=O)C=CC1=CC=CC=C1 MCULE-8126239055 [0,2,0,0,0,0|0,0,1]=3 691 B16R1.1343 COC(=O)NNC(=O)C=CC1=CC=CC=C1 MCULE-9665890318 [0,2,0,0,0,0|1,0,1]=4 692 B16R1.1343 NC(CO)CNC(=O)OCC1=CC=CC=C1 MCULE-1854404596 [0,2,0,0,0,0|1,0,1]=4 693 B16R1.1343 NNC(=O)CNC(=O)C=CC1=CC=CC=C1 MCULE-2245141977 [0,2,0,0,0,0|0,0,2]=4 694 B16R1.1343 O=C(NCC(O)CO)OCC1=CC=CC=C1 MCULE-1308171895 [0,2,0,0,0,0|1,0,1]=4 695 B16R1.1343 O=C(NC[C@@H](O)CO)OCC1=CC=CC=C1 MCULE-1528996197 [0,2,0,0,0,0|1,0,1]=4 696 B16R1.1343 O=C(NC[C@@H](O)CO)OCC1=CC=CC=C1 MCULE-8872157895 [0,2,0,0,0,0|1,0,1]=4 697 B16R1.1343 O=C(NC[C@H](O)CO)OCC1=CC=CC=C1 MCULE-4819081178 [0,2,0,0,0,0|1,0,1]=4 698 B16R1.1343 O=C(NC[C@H](O)CO)OCC1=CC=CC=C1 MCULE-7743573653 [0,2,0,0,0,0|1,0,1]=4 699 B16R1.1570 CC(CCO)NC(=O)OCC1=CC=CC=C1 MCULE-7471863822 [0,2,0,0,0,0|1,0,1]=4 700 B16R1.1570 CCCC(C)NC(=O)C=CC1=CC=CC=C1 MCULE-5073254689 [0,2,0,0,0,0|1,0,0]=3 701 B16R1.1570 COCC(C)NC(=O)C=CC1=CC=CC=C1 MCULE-5880478178 [0,2,0,0,0,0|0,0,0]=2 702 B16R1.1570 COCC(C)NC(=O)CCC1=CC=CC=C1 MCULE-2042931022 [0,2,0,0,0,0|0,0,2]=4 703 B16R1.1570 COCC(C)NC(=O)COC1=CC=CC=C1 MCULE-8133273312 [0,2,0,0,0,0|1,0,1]=4 704 B16R1.1570 COCC(C)NC(=O)CSC1=CC=CC=C1 MCULE-3796299608 [0,2,0,0,0,0|1,0,1]=4 705 B16R1.1570 C[C@@H](CCO)NC(=O)OCC1=CC=CC=C1 MCULE-9593948417 [0,2,0,0,0,0|1,0,1]=4 706 B16R1.1570 C[C@H](CCO)NC(=O)OCC1=CC=CC=C1 MCULE-7093164579 [0,2,0,0,0,0|1,0,1]=4 707 B16R1.1696 CC1=CC=CC=C1OCC(=O)NCCCO MCULE-6073382691 [0,2,0,0,0,0|1,0,1]=4 708 B16R1.1696 COCCNC(=O)C=CC1=C(C=CC=C1)Cl MCULE-9165071341 [0,2,0,0,0,0|0,0,0]=2 709 B16R1.1696 COCCNC(=O)COC1=C(C=CC=C1)Br MCULE-9064545193 [0,2,0,0,0,0|1,0,1]=4 710 B16R1.1696 COCCNC(=O)COC1=C(C=CC=C1)C MCULE-3202453531 [0,2,0,0,0,0|1,0,1]=4 711 B16R1.1696 COCCNC(=O)COC1=C(C=CC=C1)Cl MCULE-4954756552 [0,2,0,0,0,0|1,0,1]=4 712 B16R1.1696 COCCNC(=O)COC1=CC=CC=C1I MCULE-4250611714 [0,2,0,0,0,0|1,0,1]=4 713 B16R1.78 CC1=CC=C(C=C1)C(=O)CC(=O)CCCO MCULE-1835329455 [0,2,0,0,0,0|1,0,1]=4 714 B16R1.78 O=C(CCCO)CC(=O)C1=CC=C(C=C1)F MCULE-9796121448 [0,2,0,0,0,0|1,0,1]=4 715 B16R1.659 CC1=CC(=CC=C1)NC(=O)C(=O)NCCO MCULE-8780881661 [0,2,0,0,0,0|1,0,0]=3 716 B16R1.659 CCCNC(=O)C(=O)NC1=CC(=CC=C1)F MCULE-9759464036 [0,2,0,0,0,0|2,0,0]=4 717 B16R1.659 CCCNC(=O)C(=O)NC1=CC=CC(=C1)C MCULE-4426715784 [0,2,0,0,0,0|2,0,0]=4 718 B16R1.659 CCCNC(=O)C(=O)NC1=CC=CC(=C1)Cl MCULE-6039766809 [0,2,0,0,0,0|2,0,0]=4 719 B16R1.659 O=C(NCCO)C(=O)NC1=CC(=CC=C1)Cl MCULE-7105925439 [0,2,0,0,0,0|1,0,0]=3 720 B16R1.659 O=C(NCCO)C(=O)NC1=CC(=CC=C1)O MCULE-9830612002 [0,2,0,0,0,0|1,0,0]=3 721 B16R1.659 O=C(NCCO)C(=O)NC1=CC=CC(=C1)Br MCULE-3494167478 [0,2,0,0,0,0|1,0,0]=3 722 B16R1.659 O=C(NCCO)C(=O)NC1=CC=CC(=C1)F MCULE-6390794876 [0,2,0,0,0,0|1,0,0]=3 723 B16R1.851 CCC(C)NC(=O)C=CC1=CC=CC(=C1)Cl MCULE-5587158303 [0,2,0,0,0,0|1,0,0]=3 724 B16R1.11227 CC(C)CNC(=O)C=CC1=CC=CC(=C1)Cl MCULE-2934376305 [0,2,0,0,0,0|1,0,0]=3 725 B16R1.11227 O=C(O)CNC(=O)C=CC1=CC=CC(=C1)Cl MCULE-5724108923 [0,2,0,0,0,0|0,0,1]=3 726 B16R1.20760 C#CCNC(=O)/C=C/C1=CC=C(C(=C1)O)O MCULE-6555815313 [0,2,0,0,0,0|1,0,1]=4 727 B16R1.20760 C#CCNC(=O)C=CC1=CC(=C(C=C1)O)O MCULE-4469253675 [0,2,0,0,0,0|1,0,1]=4 728 B16R1.20760 C=CCNC(=O)C=CC1=CC=C(C(=C1)Cl)Cl MCULE-6538042554 [0,2,0,0,0,0|1,0,1]=4 729 B16R1.20760 CC1=CC(=CC=C1Cl)OCC(=O)NCCO MCULE-1817270993 [0,2,0,0,0,0|1,0,1]=4 730 B16R1.20760 CC1=CC=C(C=C1C)OCC(=O)NCCO MCULE-4333309872 [0,2,0,0,0,0|1,0,1]=4 731 B16R1.658 CC1=CC=C(C=C1)NC(=O)C(=O)NCCO MCULE-9305812106 [0,2,0,0,0,0|1,0,0]=3 732 B16R1.658 CC1=CC=C(C=C1)NC(=O)C(=O)OCCO MCULE-4258391667 [0,2,0,0,0,0|2,0,0]=4 733 B16R1.658 CCCNC(=O)C(=O)NC1=CC=C(C=C1)C MCULE-8778579799 [0,2,0,0,0,0|2,0,0]=4 734 B16R1.658 CCCNC(=O)C(=O)NC1=CC=C(C=C1)F MCULE-5326700155 [0,2,0,0,0,0|2,0,0]=4 735 B16R1.658 O=C(NCCO)C(=O)NC1=CC=C(C=C1)Br MCULE-6280593135 [0,2,0,0,0,0|1,0,0]=3 736 B16R1.658 O=C(NCCO)C(=O)NC1=CC=C(C=C1)Cl MCULE-8488186036 [0,2,0,0,0,0|1,0,0]=3 737 B16R1.658 O=C(NCCO)C(=O)NC1=CC=C(C=C1)F MCULE-6672034774 [0,2,0,0,0,0|1,0,0]=3 738 B16R1.658 O=C(NCCO)C(Br)CC1=CC=C(C=C1)F MCULE-6235787278 [0,2,0,0,0,0|0,0,2]=4 739 B16R1.850 CCC(C)NC(=O)C=CC1=CC=C(C=C1)Br MCULE-4935621727 [0,2,0,0,0,0|1,0,0]=3 740 B16R1.850 CCC(C)NC(=O)C=CC1=CC=C(C=C1)C MCULE-1778966982 [0,2,0,0,0,0|1,0,0]=3 741 B16R1.850 CCC(C)NC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9877845004 [0,2,0,0,0,0|1,0,0]=3 742 B16R1.850 CCC(C)NC(=O)C=CC1=CC=C(C=C1)F MCULE-7301542471 [0,2,0,0,0,0|1,0,0]=3 743 B16R1.1061 CC(C)CNC(=O)C=CC1=CC=C(C=C1)Br MCULE-7162864999 [0,2,0,0,0,0|1,0,0]=3 744 B16R1.1061 CC(C)CNC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4157303458 [0,2,0,0,0,0|1,0,0]=3 745 B16R1.1061 CC(C)CNC(=O)C=CC1=CC=C(C=C1)F MCULE-8902798618 [0,2,0,0,0,0|1,0,0]=3 746 B16R1.1061 CC1=CC=C(C=C1)C=CC(=O)NCC(C)C MCULE-4534086859 [0,2,0,0,0,0|1,0,0]=3 747 B16R1.1061 O=C(O)CCC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-1278113796 [0,2,0,0,0,0|1,0,1]=4 748 B16R1.1061 O=C(O)CCC(=O)C=CC1=CC=C(C=C1)Br MCULE-4548206522 [0,2,0,0,0,0|1,0,1]=4 749 B16R1.1061 O=C(O)CNC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4774731482 [0,2,0,0,0,0|0,0,1]=3 750 B16R1.1478 CC1=C(C=CC(=C1)Br)OCC(=O)NCCO MCULE-2873050997 [0,2,0,0,0,0|1,0,1]=4 751 B16R1.1478 CC1=C(C=CC(=C1)Cl)OCC(=O)NCCO MCULE-3149532451 [0,2,0,0,0,0|1,0,1]=4 752 B16R1.1478 CC1=CC(=C(C=C1)OCC(=O)NCCO)Br MCULE-3780857249 [0,2,0,0,0,0|1,0,1]=4 753 B16R1.1478 CC1=CC(=C(C=C1)OCC(=O)NCCO)C MCULE-1343822077 [0,2,0,0,0,0|1,0,1]=4 754 B16R1.1478 CCCNC(=O)C=CC1=C(C=C(C=C1)Cl)Cl MCULE-2387428507 [0,2,0,0,0,0|1,0,0]=3 755 B16R1.1478 O=C(COC1=C(C=C(C=C1)Br)Cl)NCCO MCULE-3953262906 [0,2,0,0,0,0|1,0,1]=4 756 B16R1.1478 O=C(COC1=C(C=C(C=C1)Cl)Br)NCCO MCULE-1948134507 [0,2,0,0,0,0|1,0,1]=4 757 B16R1.1478 O=C(COC1=C(C=C(C=C1)Cl)Cl)NCCO MCULE-5382185422 [0,2,0,0,0,0|1,0,1]=4 758 B16R1.1480 C=CCNC(=O)C=CC1=CC=C(C=C1)OC MCULE-5702529973 [0,2,0,0,0,0|1,0,1]=4 759 B16R1.1480 CCCNC(=O)C=CC1=CC=C(C=C1)OC MCULE-4055063755 [0,2,0,0,0,0|1,0,0]=3 760 B16R1.1480 COC1=CC=C(C=C1)CCC(=O)NCCO MCULE-5596447142 [0,2,0,0,0,0|0,0,2]=4 761 B16R1.1480 COC1=CC=C(C=C1)OCC(=O)NCCO MCULE-9104133206 [0,2,0,0,0,0|1,0,1]=4 762 B16R1.945 CN(CCO)C(=O)C(N)CC1=CC=CC=C1 MCULE-2368968444 [0,2,0,0,0,0|0,0,2]=4 763 B16R1.945 CN(CCO)C(=O)C(N)CC1=CC=CC=C1 MCULE-9037280222 [0,2,0,0,0,0|0,0,2]=4 764 B16R1.1127 CCC(C)NC(=O)C(=CC1=CC=CC=C1)C MCULE-5940114735 [0,2,0,0,0,0|1,0,0]=3 765 B16R1.1127 CCC(C)NC(=O)C(=O)NC1=CC=CC=C1 MCULE-6330263932 [0,2,0,0,0,0|2,0,0]=4 766 B16R1.1284 C=C(CC1=CC=CC=C1)C(=O)NCC(=O)O MCULE-9196881949 [0,2,0,0,0,0|0,0,2]=4 767 B16R1.1284 CC(=CC1=CC=CC=C1)C(=O)NCC(C)C MCULE-3224804012 [0,2,0,0,0,0|1,0,0]=3 768 B16R1.1284 CC(O)CNC(=O)C(=O)NC1=CC=CC=C1 MCULE-9116251639 [0,2,0,0,0,0|1,0,0]=3 769 B16R1.7523 CC1=CC=CC=C1NC(=O)C(=O)NCCO MCULE-5937662215 [0,2,0,0,0,0|1,0,0]=3 770 B16R1.7523 CCCNC(=O)C(=O)NC1=CC=CC=C1C MCULE-3964811608 [0,2,0,0,0,0|2,0,0]=4 771 B16R1.7523 CCCNC(=O)C(=O)NC1=CC=CC=C1Cl MCULE-4963091751 [0,2,0,0,0,0|2,0,0]=4 772 B16R1.7523 CCCNC(=O)C(=O)NC1=CC=CC=C1F MCULE-9874429996 [0,2,0,0,0,0|2,0,0]=4 773 B16R1.7523 O=C(NCCO)C(=O)NC1=CC=CC=C1Cl MCULE-8992385333 [0,2,0,0,0,0|1,0,0]=3 774 B16R1.7523 O=C(NCCO)C(=O)NC1=CC=CC=C1F MCULE-6949572536 [0,2,0,0,0,0|1,0,0]=3 775 B16R1.7289 CCC(CC)NC(=O)C=CC1=CC=CC=C1 MCULE-8617208602 [0,2,0,0,0,0|1,0,0]=3 776 B16R1.7289 CCC(CO)NC(=O)C=CC1=CC=CC=C1 MCULE-8748610286 [0,2,0,0,0,0|0,0,0]=2 777 B16R1.7289 CCC(CO)NC(=O)CCC1=CC=CC=C1 MCULE-5409864450 [0,2,0,0,0,0|0,0,2]=4 778 B16R1.7289 CCC(CO)NC(=O)COC1=CC=CC=C1 MCULE-5788831677 [0,2,0,0,0,0|1,0,1]=4 779 B16R1.7289 CCC(CO)NC(=O)OCC1=CC=CC=C1 MCULE-4131330836 [0,2,0,0,0,0|1,0,1]=4 780 B16R1.7289 CC[C@@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-2227693380 [0,2,0,0,0,0|1,0,1]=4 781 B16R1.7289 CC[C@@H](CO)NC(=O)OCC1=CC=CC=C1 MCULE-4950557638 [0,2,0,0,0,0|1,0,1]=4 782 B16R1.7289 O=C(NC(CO)CO)OCC1=CC=CC=C1 MCULE-2209338104 [0,2,0,0,0,0|1,0,1]=4 783 B16R1.10317 CC(C)(CO)NC(=O)OCC1=CC=CC=C1 MCULE-4435290715 [0,2,0,0,0,0|1,0,1]=4 784 B16R1.400 CC(C)CNC(=O)C=CC1=C(C=CC=C1)Cl MCULE-3497017285 [0,2,0,0,0,0|1,0,0]=3 785 B16R1.400 CC1=CC=CC=C1C=CC(=O)NCC(=O)O MCULE-7770820823 [0,2,0,0,0,0|0,0,1]=3 786 B16R1.400 O=C(O)CNC(=O)C=CC1=CC=CC=C1Cl MCULE-4437402883 [0,2,0,0,0,0|0,0,1]=3 787 B16R1.400 O=C(O)CNC(=O)C=CC1=CC=CC=C1F MCULE-7315957610 [0,2,0,0,0,0|0,0,1]=3 788 B16R1.1454 C=CCNC(=O)C=CC1=CC=CC=C1OC MCULE-9620974263 [0,2,0,0,0,0|1,0,1]=4 789 B16R1.1454 COC1=C(C=CC=C1)OCC(=O)NCCO MCULE-3323926399 [0,2,0,0,0,0|1,0,1]=4 790 B16R1.1454 N#CC1=C(C=CC=C1)C=CC(=O)NCCO MCULE-4324310188 [0,2,0,0,0,0|0,0,0]=2 791 B16R1.90074 C=CCNC(=O)C=CC1=C(C=CC=C1Cl)F MCULE-1765756017 [0,2,0,0,0,0|1,0,1]=4 792 B16R1.90074 CCCNC(=O)C=CC1=C(C=CC=C1Cl)Cl MCULE-4716729455 [0,2,0,0,0,0|1,0,0]=3 793 B16R1.1771 O=C(O)CNS(=O)(=O)C=CC1=CC=CC=C1 MCULE-2299455268 [0,2,0,0,0,0|1,0,1]=4 794 B16R1.22556 CC(C)(O)CNC(=O)OCC1=CC=CC=C1 MCULE-4639514921 [0,2,0,0,0,0|1,0,1]=4 795 B14R1.939 COC1=CC=CC=C1C(=O)NCCO MCULE-8793967489 [0,0,1,1,0,0|1,0,1]=4 796 B14R1.939 CSC1=C(C=CC=C1)C(=O)NCCO MCULE-1700696741 [0,0,1,1,0,0|1,0,1]=4 797 B14R1.934 C#CC1=CC(=CC=C1)C(=O)NCCO MCULE-2301729832 [0,0,1,1,0,0|0,0,2]=4 798 B14R1.934 C=CC1=CN=CC(=C1)C(=O)NCCC MCULE-2383887170 [0,0,1,1,0,0|2,0,0]=4 799 B14R1.934 COC1=CC(=CC=C1)C(=O)NCCO MCULE-9758211575 [0,0,1,1,0,0|1,0,1]=4 800 B14R1.918 NC1=CC(=C(C=C1)Cl)C(=O)NCCO MCULE-3428859350 [0,0,1,1,0,0|2,0,0]=4 801 B14R1.918 O=C(NCCO)C1=C(C=CC(=C1)F)Br MCULE-2502219761 [0,0,1,1,0,0|2,0,0]=4 802 B14R1.918 O=C(NCCO)C1=C(C=CC(=C1)O)O MCULE-4553214202 [0,0,1,1,0,0|2,0,0]=4 803 B14R1.918 O=C(NCCO)C1=CC(=CC=C1F)F MCULE-4249411745 [0,0,1,1,0,0|2,0,0]=4 804 B14R2.3 OCCCC1=CNC2=C1C=CC=C2 MCULE-2483523215 [1,0,0,1,0,0|2,0,0]=4 805 B14R2.3 OCCNC1=NSC2=CC=CC=C12 MCULE-9687624791 [1,0,0,1,0,0|2,0,0]=4 806 B14R2.101 C1=CC=C(C=C1)C=CC2CCCO2 MCULE-5978356401 [1,0,0,1,0,0|1,0,1]=4 807 B14R2.3018 C1=CC=C(C=C1)/C=C/CNC2CC2 MCULE-1168668808 [1,0,0,1,0,0|1,0,1]=4 808 B14R2.3018 C1=CC=C(C=C1)/C=C/CNC2CC2 MCULE-3948419123 [1,0,0,1,0,0|1,0,1]=4 809 B14R2.3018 C1=CC=C(C=C1)C=CCNC2CC2 MCULE-5915994537 [1,0,0,1,0,0|1,0,1]=4 810 B14R2.3018 C1=CC=C(C=C1)C=CCNC2CC2 MCULE-8984032259 [1,0,0,1,0,0|1,0,1]=4 811 B14R2.7150 BrCCC1=CC=CC2=C1C=CC=C2 MCULE-6812937321 [1,0,0,1,0,0|2,0,0]=4 812 B14R2.7150 CCCC1=CC=CC2=CC=CC=C12 MCULE-5192828187 [1,0,0,1,0,0|2,0,0]=4 813 B14R2.7150 ClCCC1=CC=CC2=C1C=CC=C2 MCULE-9174855136 [1,0,0,1,0,0|2,0,0]=4 814 B14R2.7150 NCCC1=C2C=CC=CC2=CC=C1 MCULE-2417695210 [1,0,0,1,0,0|2,0,0]=4 815 B14R2.7150 NCCC1=CC=CC2=CC=CC=C12 MCULE-1820362379 [1,0,0,1,0,0|2,0,0]=4 816 B14R2.7150 OCCC1=C2C=CC=CC2=CC=C1 MCULE-3909988138 [1,0,0,1,0,0|1,0,0]=3 817 B14R2.7150 OCCC1=C2C=CC=CC2=NC=C1 MCULE-9858442028 [1,0,0,1,0,0|2,0,0]=4 818 B14R2.7150 OCCC1=CC=CC2=NC=CC=C12 MCULE-7284143132 [1,0,0,1,0,0|2,0,0]=4 819 B14R2.7150 OCCN1C=CNC2=C1C=CC=C2 MCULE-9149238921 [1,0,0,1,0,0|1,0,0]=3 820 B14R2.7150 ONCC1=C2C=CC=CC2=CC=C1 MCULE-7083316608 [1,0,0,1,0,0|2,0,0]=4 821 B14R2.7150 SCCC1=C2C=CC=CC2=CC=C1 MCULE-5222689089 [1,0,0,1,0,0|1,1,0]=4 822 B14R2.21 O=C1C=C(C=CN1)C2=CC=CC=C2 MCULE-9445979936 [1,0,0,1,0,0|0,0,2]=4 823 B14R2.21 O=C1C=C(C=NN1)C2=CC=CC=C2 MCULE-6840743001 [1,0,0,1,0,0|1,0,1]=4 824 B14R2.21 O=C1C=C(CCC1)C2=CC=CC=C2 MCULE-8110445795 [1,0,0,1,0,0|1,0,0]=3 825 B14R2.21 O=C1C=C(N=CN1)C2=CC=CC=C2 MCULE-9122405753 [1,0,0,1,0,0|1,0,1]=4 826 B14R2.21 O=C1C=C(OCC1)C2=CC=CC=C2 MCULE-9431035204 [1,0,0,1,0,0|0,0,0]=2 827 B14R2.21 O=C1C=COC(=C1)C2=CC=CC=C2 MCULE-5968331124 [1,0,0,1,0,0|0,0,2]=4 828 B14R2.21 O=C1CC(CCN1)C2=CC=CC=C2 MCULE-7567412186 [1,0,0,1,0,0|0,0,2]=4 829 B14R2.21 O=C1CCOC(C1)C2=CC=CC=C2 MCULE-4672649666 [1,0,0,1,0,0|0,0,2]=4 830 B14R2.21 O=C1CN(CCN1)C2=CC=CC=C2 MCULE-7367933909 [1,0,0,1,0,0|1,0,1]=4 831 B14R2.112 BrCCC1=CC2=CC=CC=C2C=C1 MCULE-5759232573 [1,0,0,1,0,0|2,0,0]=4 832 B14R2.112 CCCC1=CC=C2C=CC=CC2=C1 MCULE-1688232916 [1,0,0,1,0,0|2,0,0]=4 833 B14R2.112 CCNC1=CC2=C(C=CC=C2)C=C1 MCULE-3339632844 [1,0,0,1,0,0|1,0,0]=3 834 B14R2.112 CCNC1=CC=C2C=CC=CC2=C1 MCULE-1702719021 [1,0,0,1,0,0|1,0,0]=3 835 B14R2.112 CCOC1=CC2=C(C=CC=C2)C=C1 MCULE-4517434071 [1,0,0,1,0,0|2,0,0]=4 836 B14R2.112 CCOC1=NC2=CC=CC=C2C=C1 MCULE-3692051615 [1,0,0,1,0,0|2,0,0]=4 837 B14R2.112 CCSC1=CC=C2C=CC=CC2=C1 MCULE-3302763855 [1,0,0,1,0,0|2,0,0]=4 838 B14R2.112 NCCC1=CC2=CC=CC=C2C=C1 MCULE-3378750006 [1,0,0,1,0,0|2,0,0]=4 839 B14R2.112 NCCC1=CC2=CC=CC=C2C=C1 MCULE-5409569236 [1,0,0,1,0,0|2,0,0]=4 840 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 MCULE-4900551077 [1,0,0,1,0,0|2,0,0]=4 841 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 MCULE-6212278905 [1,0,0,1,0,0|2,0,0]=4 842 B14R2.112 NCCC1=NC2=C(C=CC=C2)C=C1 MCULE-4011839049 [1,0,0,1,0,0|2,0,0]=4 843 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 MCULE-1523795787 [1,0,0,1,0,0|2,0,0]=4 844 B14R2.112 OCCC1=CC2=C(C=CC=C2)C=C1 MCULE-9420229393 [1,0,0,1,0,0|1,0,0]=3 845 B14R2.112 OCCC1=CC=C2C=CC=NC2=C1 MCULE-2776688980 [1,0,0,1,0,0|2,0,0]=4 846 B14R2.112 OCCC1=NC2=C(C=CC=N2)C=C1 MCULE-2821659809 [1,0,0,1,0,0|2,0,0]=4 847 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 MCULE-2769690888 [1,0,0,1,0,0|1,0,0]=3 848 B14R2.112 ONCC1=CC2=C(C=CC=C2)C=C1 MCULE-1558496032 [1,0,0,1,0,0|2,0,0]=4 849 B14R2.112 SCCC1=CC2=CC=CC=C2C=C1 MCULE-8804500027 [1,0,0,1,0,0|1,1,0]=4 850 B14R2.203 CC[N+]1=C(C=CC2=CC=CC=C12)C MCULE-6262026784 [1,0,0,1,0,0|1,0,1]=4 851 B14R2.203 CC[N+]1=C2C=CC=CC2=CC=C1C MCULE-4035972899 [1,0,0,1,0,0|1,0,1]=4 852 B14R2.203 CC[N+]1=C2C=CC=CC2=CC=C1C MCULE-4491853090 [1,0,0,1,0,0|1,0,1]=4 853 B14R2.203 O=C1C=CC2=C(C1=NO)C=CC=C2 MCULE-5269362268 [1,0,0,1,0,0|1,0,1]=4 854 B14R2.598 CC1NC(=O)CC1C2=CC=CC=C2 MCULE-4685085818 [1,0,0,1,0,0|0,0,2]=4 855 B14R2.598 CC1NC(=O)OC1C2=CC=CC=C2 MCULE-2468672856 [1,0,0,1,0,0|1,0,1]=4 856 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 MCULE-3835254569 [1,0,0,1,0,0|1,0,1]=4 857 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 MCULE-6053334364 [1,0,0,1,0,0|1,0,1]=4 858 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 MCULE-6372117629 [1,0,0,1,0,0|1,0,1]=4 859 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 MCULE-6170972533 [1,0,0,1,0,0|1,0,1]=4 860 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 MCULE-8331458403 [1,0,0,1,0,0|1,0,1]=4 861 B14R2.598 O=C1C=C(C(=O)N1)C2=CC=CC=C2 MCULE-2828609657 [1,0,0,1,0,0|0,0,2]=4 862 B14R2.2899 O=C(C=CC1=CC=CC=C1)C2CC2 MCULE-5412419023 [1,0,0,1,0,0|1,0,0]=3 863 B14R2.2899 O=C(OCC1=CC=CC=C1)C2CO2 MCULE-5130204410 [1,0,0,1,0,0|1,0,1]=4 864 B14R2.2899 O=C(OCC1=CC=CC=C1)N2CC2 MCULE-9655637810 [1,0,0,1,0,0|1,0,1]=4 865 B14R2.67 OCCCC1=CC2=C(N1)C=CC=C2 MCULE-8873780691 [0,0,0,1,1,0|2,0,0]=4 866 B14R2.67 OCCNC1=NC2=C(N1)C=CC=C2 MCULE-3034866443 [0,0,0,1,1,0|2,0,0]=4 867 B14R2.67 OCCNC1=NC2=C(O1)C=CC=C2 MCULE-8388826630 [0,0,0,1,1,0|1,0,1]=4 868 B14R2.67 OCCNC1=NC2=C(S1)C=CC=C2 MCULE-4352905750 [0,0,0,1,1,0|1,1,0]=4 869 B14R2.67 OCCNC1=NC2=CC=CC=C2N1 MCULE-2188540565 [0,0,0,1,1,0|2,0,0]=4 870 B14R2.67 OCCNC1=NC2=CC=CC=C2N1 MCULE-7614135663 [0,0,0,1,1,0|2,0,0]=4 871 B14R2.277 CC1=C(C(=O)NC1)C2=CC=CC=C2 MCULE-6451024280 [0,0,0,1,1,0|1,0,1]=4 872 B14R2.517 CC1=CC2=C(N1CCN)C=CC=C2 MCULE-6960002407 [0,0,0,1,1,0|2,0,0]=4 873 B14R2.517 CC1=CC2=C(N1CCO)C=CC=C2 MCULE-1979507920 [0,0,0,1,1,0|1,0,0]=3 874 B14R2.517 CC1=CC2=CC=CC=C2N1CCN MCULE-2055409192 [0,0,0,1,1,0|2,0,0]=4 875 B14R2.517 CC1=CC2=CC=CC=C2N1CCN MCULE-3661401945 [0,0,0,1,1,0|2,0,0]=4 876 B14R2.517 CC1=NC2=CC=CC=C2N1CCO MCULE-8319365614 [0,0,0,1,1,0|2,0,0]=4 877 B14R2.517 CCCN1C(=O)NC2=CC=CC=C12 MCULE-3910055339 [0,0,0,1,1,0|2,0,0]=4 878 B14R2.517 NC1=NC2=C(N1CCO)C=CC=C2 MCULE-4155018807 [0,0,0,1,1,0|2,0,0]=4 879 B14R2.517 NCCN1C(=O)CC2=C1C=CC=C2 MCULE-9493723196 [0,0,0,1,1,0|1,0,1]=4 880 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 MCULE-5935193390 [0,0,0,1,1,0|2,0,0]=4 881 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 MCULE-9516593815 [0,0,0,1,1,0|2,0,0]=4 882 B14R2.517 NCCN1C(=O)OC2=C1C=CC=C2 MCULE-1784740972 [0,0,0,1,1,0|2,0,0]=4 883 B14R2.517 NCCN1C(=O)OC2=C1C=CC=C2 MCULE-6007362978 [0,0,0,1,1,0|2,0,0]=4 884 B14R2.517 O=C1NC2=C(C1CCO)C=CC=C2 MCULE-1851539027 [0,0,0,1,1,0|2,0,0]=4 885 B14R2.517 O=C1NC2=C(N1CCCl)C=CC=C2 MCULE-1156604675 [0,0,0,1,1,0|2,0,0]=4 886 B14R2.517 O=C1NC2=C(N1CCO)C=CC=C2 MCULE-8159258664 [0,0,0,1,1,0|1,0,0]=3 887 B14R2.517 O=C1NC2=CC=CC=C2N1CCBr MCULE-9219773231 [0,0,0,1,1,0|2,0,0]=4 888 B14R2.517 O=C1OC2=C(N1CCBr)C=CC=C2 MCULE-5352364126 [0,0,0,1,1,0|2,0,0]=4 889 B14R2.517 O=C1OC2=C(N1CCO)C=CC=C2 MCULE-8034923028 [0,0,0,1,1,0|1,0,0]=3 890 B14R2.517 O=C1SC2=CC=CC=C2N1CCCl MCULE-6396402274 [0,0,0,1,1,0|2,0,0]=4 891 B14R2.517 O=C1SC2=CC=CC=C2N1CCO MCULE-3256957848 [0,0,0,1,1,0|1,0,0]=3 892 B14R2.517 OCCN1C(=NC2=C1C=CC=C2)Cl MCULE-1453719630 [0,0,0,1,1,0|2,0,0]=4 893 B14R2.517 OCCN1C(=NC2=C1C=CC=C2)S MCULE-6147791473 [0,0,0,1,1,0|1,1,0]=4 894 B14R2.9593 O=C(CC1=CC=CC=C1)NC2CC2 MCULE-7458541762 [0,0,0,1,1,0|1,0,1]=4 895 B14R2.9593 O=C(NC1=CC=CC=C1)NC2CC2 MCULE-3447468466 [0,0,0,1,1,0|2,0,0]=4 896 B14R2.9593 O=C(NC1CC1)OC2=CC=CC=C2 MCULE-1604992047 [0,0,0,1,1,0|2,0,0]=4 897 B14R2.13184 O=C(C=CC1=CC=CO1)NC2CC2 MCULE-3579712924 [0,0,0,1,1,0|2,0,0]=4 898 B16R2.15 O=C1CC(C(=NN1)C2=CC=CC=C2)CO MCULE-1792194190 [0,0,0,1,0,1|2,0,0]=4 899 B16R2.15 O=C1NN=C(C(N1)NO)C2=CC=CC=C2 MCULE-7408404825 [0,0,0,1,0,1|2,0,0]=4 900 B16R2.37 C=CCNC(=O)C1=CNC2=C1C=CC=C2 MCULE-2595577045 [0,0,0,1,0,1|1,0,1]=4 901 B16R2.37 CCCCC(=O)C1=CSC2=C1C=CC=C2 MCULE-6253387433 [0,0,0,1,0,1|2,0,0]=4 902 B16R2.37 CCCNC(=O)C1=CNC2=CC=CC=C12 MCULE-2699840493 [0,0,0,1,0,1|1,0,0]=3 903 B16R2.37 NCCNC(=O)C1=C2C=CC=CC2=NN1 MCULE-1352562387 [0,0,0,1,0,1|2,0,0]=4 904 B16R2.37 NCCNC(=O)C1=C2C=CC=CC2=NN1 MCULE-4676449430 [0,0,0,1,0,1|2,0,0]=4 905 B16R2.37 NCCNC(=O)C1=CNC2=CC=CC=C12 MCULE-1071920919 [0,0,0,1,0,1|1,0,0]=3 906 B16R2.37 NCCNC(=O)C1=CNC2=CC=CC=C12 MCULE-7820132868 [0,0,0,1,0,1|1,0,0]=3 907 B16R2.37 O=C(CCCCl)C1=CSC2=C1C=CC=C2 MCULE-7441543498 [0,0,0,1,0,1|2,0,0]=4 908 B16R2.71 O=C1CCCCC1=CNC2=CC=CC=C2 MCULE-2990209582 [0,0,0,1,0,1|2,0,0]=4 909 B16R2.71 O=C1NCCCC1=NNC2=CC=CC=C2 MCULE-2546653731 [0,0,0,1,0,1|2,0,0]=4 910 B16R2.150 CCCNC1=NC(=CS1)C2=CC=CC=C2 MCULE-5821554865 [0,0,0,1,0,1|2,0,0]=4 911 B16R2.2948 O=C1CCC(=C1/C=C/C2=CC=CC=C2)O MCULE-9235299736 [0,0,0,1,0,1|1,0,1]=4 912 B16R2.2948 O=C1CNC(=O)C1=CNC2=CC=CC=C2 MCULE-6754034708 [0,0,0,1,0,1|0,0,2]=4 913 B16R2.3602 CC1=CN=C(N1CCN)C2=CC=CC=C2 MCULE-1961117434 [0,0,0,1,0,1|2,0,0]=4 914 B16R2.3602 CC1=CN=C(N1CCN)C2=CC=CC=C2 MCULE-8967489942 [0,0,0,1,0,1|2,0,0]=4 915 B16R2.3602 CC1=[N+](C(=CS1)C2=CC=CC=C2)CCO MCULE-2032669207 [0,0,0,1,0,1|1,0,1]=4 916 B16R2.3602 CC1=[N+](C(=CS1)C2=CC=CC=C2)CCO MCULE-7124659104 [0,0,0,1,0,1|1,0,1]=4 917 B16R2.3602 OCCN1C(=NN=C1C2=CC=CC=C2)S MCULE-4384347513 [0,0,0,1,0,1|1,1,0]=4 918 B16R2.2238 O=C(/C=C/C1=CC=CC=C1)N2CCCC2 MCULE-1069152127 [0,1,0,1,0,0|1,0,0]=3 919 B16R2.2238 O=C(C=CC1=CC=CC=C1)N2CCCC2 MCULE-6494403356 [0,1,0,1,0,0|1,0,0]=3 920 B16R2.2441 OCCCCC1=CC=C2C=CC=CC2=C1 MCULE-1802943962 [0,1,0,1,0,0|2,0,0]=4 921 B16R2.3193 O=C(NC1CC1O)OCC2=CC=CC=C2 MCULE-6663513752 [0,1,0,1,0,0|1,0,1]=4 922 B16R2.3193 O=C(N[C@@H]1C[C@@H]1O)OCC2=CC=CC=C2 MCULE-9152291395 [0,1,0,1,0,0|1,0,1]=4 923 B16R2.3193 O=C(N[C@@H]1C[C@H]1O)OCC2=CC=CC=C2 MCULE-5764624316 [0,1,0,1,0,0|1,0,1]=4 924 B16R2.44148 O=C(NC1COC1)OCC2=CC=CC=C2 MCULE-2864899635 [0,1,0,1,0,0|1,0,1]=4 925 B16R2.44153 O=C(NCC1CO1)OCC2=CC=CC=C2 MCULE-5075488101 [0,1,0,1,0,0|1,0,1]=4 926 B16R2.19 CCC1=NC(=CC(=O)N1)C2=CC=CC=C2 MCULE-6518707592 [0,1,0,1,0,0|1,0,1]=4 927 B16R2.88 O=C(C=C1NCCCN1)C2=CC=CC=C2 MCULE-7257690923 [0,1,0,1,0,0|2,0,0]=4 928 B16R2.551 CC1=CC(=NN1CCO)C2=NC=CC=C2 MCULE-6170276871 [0,1,0,1,0,0|2,0,0]=4 929 B16R2.551 CCCN1N=C(C=C1N)C2=CC=CC=C2 MCULE-7461979435 [0,1,0,1,0,0|2,0,0]=4 930 B16R2.551 NC1=CC(=NN1CCO)C2=CC=CC=C2 MCULE-4107446122 [0,1,0,1,0,0|1,0,0]=3 931 B16R2.551 NC1=CC(=NN1CCO)C2=CN=CC=C2 MCULE-9710476044 [0,1,0,1,0,0|2,0,0]=4 932 B16R2.551 OCCN1N=C(C=C1O)C2=CC=CC=C2 MCULE-9519162454 [0,1,0,1,0,0|0,0,1]=3 933 B16R2.1054 CC1=C2C=CC=CC2=NC(=C1)NCCO MCULE-6411716794 [0,1,0,1,0,0|1,0,0]=3 934 B16R2.1054 CC1=CC(=NC2=CC=CC=C12)NCCN MCULE-1574975712 [0,1,0,1,0,0|2,0,0]=4 935 B16R2.44545 C#CCN1C(=O)C=C(C2=C1C=CC=C2)C MCULE-7029349346 [0,1,0,1,0,0|1,0,1]=4 936 B16R2.44545 C=CCN1C(=O)C=C(C2=C1C=CC=C2)C MCULE-5680877990 [0,1,0,1,0,0|1,0,1]=4 937 B16R2.44545 CC1=CC(=O)N(C2=C1C=CC=C2)CC#N MCULE-9413356357 [0,1,0,1,0,0|1,0,1]=4 938 B16R2.44545 CCCN1C(=O)OC(=O)C2=CC=CC=C12 MCULE-3487729058 [0,1,0,1,0,0|2,0,0]=4 939 B16R2.44545 O=C1NC(=S)N(C2=CC=CC=C12)CCO MCULE-7915467759 [0,1,0,1,0,0|1,1,0]=4 940 B16R2.2923 O=C1NCCCC1=CC2=CC=CC(=C2)Br MCULE-9021972380 [0,1,0,1,0,0|1,0,0]=3 941 B16R2.11914 O=C(C=CC1=CC(=CC=C1)Br)NC2CC2 MCULE-7481586220 [0,1,0,1,0,0|1,0,0]=3 942 B16R2.11914 O=C(C=CC1=CC=CC(=C1)Cl)NC2CC2 MCULE-1911230019 [0,1,0,1,0,0|1,0,0]=3 943 B16R2.30336 NCCNC1=NC2=C(C=C1)C=C(C=C2)Cl MCULE-6205651688 [0,1,0,1,0,0|2,0,0]=4 944 B16R2.30336 OCCOC1=CC2=C(C=C1)C=C(C=C2)Br MCULE-9340058566 [0,1,0,1,0,0|2,0,0]=4 945 B16R2.1129 O=C1CCCCC1=CC2=CC=C(C=C2)Cl MCULE-4675678713 [0,1,0,1,0,0|2,0,0]=4 946 B16R2.11573 O=C1CNC(=O)C1=CC2=CC=C(C=C2)Br MCULE-1261908109 [0,1,0,1,0,0|0,0,2]=4 947 B16R2.11573 O=C1CNC(=O)C1=CC2=CC=C(C=C2)O MCULE-7863377266 [0,1,0,1,0,0|0,0,2]=4 948 B16R2.11574 CC1=CC=C(C=C1)C=CC(=O)NC2CC2 MCULE-2772344228 [0,1,0,1,0,0|1,0,0]=3 949 B16R2.11574 O=C(C=CC1=CC=C(C=C1)Br)NC2CC2 MCULE-2767281486 [0,1,0,1,0,0|1,0,0]=3 950 B16R2.11574 O=C(C=CC1=CC=C(C=C1)Cl)NC2CC2 MCULE-9621814344 [0,1,0,1,0,0|1,0,0]=3 951 B16R2.11574 O=C(C=CC1=CC=C(C=C1)F)NC2CC2 MCULE-9867296592 [0,1,0,1,0,0|1,0,0]=3 952 B16R2.1056 OCCNC1=C(N=C2C=CC=CC2=N1)Cl MCULE-7873370921 [0,1,0,1,0,0|2,0,0]=4 953 B16R2.2128 C=CCNC(=O)C1=CC2=C(O1)C=CC=C2 MCULE-6665264942 [0,1,0,1,0,0|1,0,1]=4 954 B16R2.2128 CCCNC(=O)C1=CC2=CC=CC=C2O1 MCULE-5456946075 [0,1,0,1,0,0|1,0,0]=3 955 B16R2.2128 CCNNC(=O)C1=CC2=C(N1)C=CC=C2 MCULE-5173588415 [0,1,0,1,0,0|2,0,0]=4 956 B16R2.2128 COCNC(=O)C1=CC2=C(N1)C=CC=C2 MCULE-2360530399 [0,1,0,1,0,0|2,0,0]=4 957 B16R2.2128 NCCNC(=O)C1=CC2=C(O1)C=CC=C2 MCULE-3541689020 [0,1,0,1,0,0|1,0,0]=3 958 B16R2.2128 NCCNC(=O)C1=CC2=CC=CC=C2N1 MCULE-7175027680 [0,1,0,1,0,0|1,0,0]=3 959 B16R2.2128 NCCNC(=O)C1=NC2=CC=CC=C2S1 MCULE-1750735151 [0,1,0,1,0,0|2,0,0]=4 960 B16R2.2128 O=C(NCCO)C1=CC2=C(N1)C=CC=C2 MCULE-6643039329 [0,1,0,1,0,0|0,0,0]=2 961 B16R2.2128 O=C(NCCO)C1=CN2C=CC=CC2=N1 MCULE-9143339465 [0,1,0,1,0,0|1,0,0]=3 962 B16R2.2128 O=C(NCCO)C1=NC2=CC=CC=C2N1 MCULE-7527397427 [0,1,0,1,0,0|1,0,0]=3 963 B16R2.2128 O=C(NCCO)C1=NC2=CC=CC=C2S1 MCULE-1131929700 [0,1,0,1,0,0|1,0,0]=3 964 B16R2.2400 O=C1N/C(=N\O)/SC1=CC2=CC=CC=C2 MCULE-6164587423 [0,1,0,1,0,0|1,0,1]=4 965 B16R2.2400 O=C1NC(CC1CC2=CC=CC=C2)CO MCULE-5670578672 [0,1,0,1,0,0|0,0,2]=4 966 B16R2.27766 O=C(NC1=CC=CC=C1)C(=O)NC2CC2 MCULE-3595155147 [0,1,0,1,0,0|2,0,0]=4 967 B16R2.44621 NCCN1C(=O)C(=NC2=CC=CC=C12)O MCULE-8463436672 [0,1,0,1,0,0|2,0,0]=4 968 B16R2.44621 NCCN1C(=O)C(=NC2=CC=CC=C12)O MCULE-9635855549 [0,1,0,1,0,0|2,0,0]=4 969 B16R2.5347 CC(CO)OC1=CC2=CC=CC=C2C=C1 MCULE-1590044127 [0,1,0,1,0,0|2,0,0]=4 970 B16R2.34040 CC1=C(C2=CC=CC=C2C=C1)[C@@H](N)CO MCULE-5671400734 [0,1,0,1,0,0|2,0,0]=4 971 B16R2.34040 N[C@@H](CO)C1=C(C=CC2=C1C=CC=C2)O MCULE-9438963939 [0,1,0,1,0,0|1,0,1]=4 972 B16R2.34040 N[C@@H](CO)C1=C(C=CC2=CC=CC=C12)O MCULE-4839497464 [0,1,0,1,0,0|1,0,1]=4 973 B16R2.34040 N[C@H](CO)C1=C(C=CC2=C1C=CC=C2)O MCULE-4436928901 [0,1,0,1,0,0|1,0,1]=4 974 B16R2.34040 N[C@H](CO)C1=C(C=CC2=CC=CC=C12)O MCULE-4018868292 [0,1,0,1,0,0|1,0,1]=4 975 B16R2.767 N[C@@H](CCO)C1=CC2=C(C=CC=C2)C=C1 MCULE-5873267169 [0,1,0,1,0,0|2,0,0]=4 976 B16R2.767 N[C@@H](CCO)C1=CC=C2C=CC=CC2=C1 MCULE-4988141962 [0,1,0,1,0,0|2,0,0]=4 977 B16R2.767 N[C@@H](CCO)C1=NC2=C(C=CC=C2)C=C1 MCULE-4267327384 [0,1,0,1,0,0|2,0,0]=4 978 B16R2.767 N[C@@H](CCO)C1=NC2=C(C=CC=C2)C=C1 MCULE-9269302051 [0,1,0,1,0,0|2,0,0]=4 979 B16R2.767 N[C@H](CCO)C1=CC2=C(C=CC=C2)C=C1 MCULE-7022832377 [0,1,0,1,0,0|2,0,0]=4 980 B16R2.767 N[C@H](CCO)C1=CC=C2C=CC=CC2=C1 MCULE-3780828761 [0,1,0,1,0,0|2,0,0]=4 981 B16R2.767 N[C@H](CCO)C1=NC2=C(C=CC=C2)C=C1 MCULE-3561919784 [0,1,0,1,0,0|2,0,0]=4 982 B16R2.767 N[C@H](CCO)C1=NC2=C(C=CC=C2)C=C1 MCULE-8279631047 [0,1,0,1,0,0|2,0,0]=4 983 B16R2.3322 O=C(OCC1=CC=CC=C1)N2CC(C2)O MCULE-8879174785 [0,1,0,1,0,0|1,0,1]=4 984 B16R2.14690 O=C(/C=C/C1=C(C=CC=C1)F)NC2CC2 MCULE-7289599678 [0,1,0,1,0,0|1,0,0]=3 985 B16R2.14690 O=C(C=CC1=C(C=CC=C1)Cl)NC2CC2 MCULE-8611830670 [0,1,0,1,0,0|1,0,0]=3 986 B16R2.14690 O=C(C=CC1=C(C=CC=C1)F)NC2CC2 MCULE-6143327557 [0,1,0,1,0,0|1,0,0]=3 987 B16R2.2942 CCCNC1=CSC2=CC=CC=C2C1=O MCULE-5768247149 [0,1,0,1,0,0|2,0,0]=4 988 B16R2.333 O=C(O)CN1C(=O)C=NC2=C1C=CC=C2 MCULE-3687459047 [0,1,0,1,0,0|1,0,1]=4 989 B16R2.477 CC(O)COC1=CC2=C(C=CC=C2)C=C1 MCULE-6920271928 [0,1,0,1,0,0|2,0,0]=4 990 B16R2.477 O=C(O)CNC1=CC=C2C=CC=CC2=C1 MCULE-1725837215 [0,1,0,1,0,0|1,0,1]=4 991 B16R2.322173 O=S(=O)(C=CC1=CC=CC=C1)NC2CC2 MCULE-7468780437 [0,1,0,1,0,0|2,0,0]=4 992 B16R3.3329 O=C1CCCN2C1=CC3=C2C=CC=C3 MCULE-6292449695 [0,0,0,2,0,0|2,0,0]=4 993 B16R3.3329 O=C1NCCC2=C1NC3=C2C=CC=C3 MCULE-9673359265 [0,0,0,2,0,0|2,0,0]=4 994 B16R3.3329 O=C1NCCN2C1=CC3=C2C=CC=C3 MCULE-1783434034 [0,0,0,2,0,0|1,0,0]=3 995 B16R3.9 C1=CC=C2C(=C1)N=CC3=C2OCCN3 MCULE-5448246046 [0,0,0,2,0,0|2,0,0]=4 996 B16R3.63903 C1=CC2=C(C=C1)C=C(C=C2)CC3CO3 MCULE-6400304358 [0,0,0,2,0,0|2,0,0]=4 997 B12R1.32 CCCC(=O)CC1=CC=CC=C1 MCULE-4001455569 [1,0,0,0,1,0|1,0,1]=4 998 B12R1.32 CCCC(=O)NC1=CC=CC=C1 MCULE-7754035397 [1,0,0,0,1,0|2,0,0]=4 999 B12R1.32 CCCC(=O)OC1=CC=CC=C1 MCULE-4521121597 [1,0,0,0,1,0|2,0,0]=4 1000 B12R1.32 CCNC(=O)NC1=CC=CC=C1 MCULE-9063691976 [1,0,0,0,1,0|1,0,0]=3 1001 B12R1.32 CCNC(=O)OC1=CC=CC=C1 MCULE-4551081658 [1,0,0,0,1,0|1,0,0]=3 1002 B12R1.32 CCNC(=S)NC1=CC=CC=C1 MCULE-4352585628 [1,0,0,0,1,0|1,1,0]=4 1003 B12R1.32 CCOC(=O)CC1=CC=CC=C1 MCULE-6999453149 [1,0,0,0,1,0|1,0,1]=4 1004 B12R1.32 CCOC(=O)NC1=CC=CC=C1 MCULE-7031990871 [1,0,0,0,1,0|2,0,0]=4 1005 B12R1.32 CCOC(=O)SC1=CC=CC=C1 MCULE-3543114036 [1,0,0,0,1,0|2,0,0]=4 1006 B12R1.32 CCSC(=O)NC1=CC=CC=C1 MCULE-7306653604 [1,0,0,0,1,0|2,0,0]=4 1007 B12R1.32 NCCC(=O)NC1=CC=CC=C1 MCULE-2801424190 [1,0,0,0,1,0|2,0,0]=4 1008 B12R1.32 NCCC(=O)NC1=CC=CC=C1 MCULE-7959116962 [1,0,0,0,1,0|2,0,0]=4 1009 B12R1.32 O=C(CC1=CC=CC=C1)NCO MCULE-3395883202 [1,0,0,0,1,0|0,0,1]=3 1010 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 MCULE-1165556923 [1,0,0,0,1,0|2,0,0]=4 1011 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 MCULE-9335982208 [1,0,0,0,1,0|2,0,0]=4 1012 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 MCULE-4739562529 [1,0,0,0,1,0|2,0,0]=4 1013 B12R1.32 O=C(CCS)NC1=CC=CC=C1 MCULE-7731276087 [1,0,0,0,1,0|1,1,0]=4 1014 B12R1.51 CCOC(=O)/C=C/C1=CC=CN1 MCULE-5834777761 [1,0,0,0,1,0|2,0,0]=4 1015 B12R1.51 CCOC(=O)/C=C/C1=CC=CO1 MCULE-7171775414 [1,0,0,0,1,0|2,0,0]=4 1016 B12R1.51 CCOC(=O)/C=C/C1=CC=CS1 MCULE-5761265420 [1,0,0,0,1,0|2,0,0]=4 1017 B12R1.51 CCOC(=O)/C=C/C1=CSC=C1 MCULE-1935777312 [1,0,0,0,1,0|2,0,0]=4 1018 B12R1.51 CCOC(=O)C=CC1=CC=CO1 MCULE-9891032976 [1,0,0,0,1,0|2,0,0]=4 1019 B12R1.51 CCOC(=O)C=CC1=CC=CS1 MCULE-4827683535 [1,0,0,0,1,0|2,0,0]=4 1020 B12R1.51 CCOC(=O)C=CC1=CSC=C1 MCULE-1037834889 [1,0,0,0,1,0|2,0,0]=4 1021 B12R1.30 C#CCNC(=O)C1=CC=CC=C1 MCULE-7164514311 [0,0,0,0,2,0|1,0,1]=4 1022 B12R1.30 C=CCNC(=O)C1=CC=CC=C1 MCULE-8999844510 [0,0,0,0,2,0|1,0,1]=4 1023 B12R1.30 CC(NCCO)C1=CC=CC=C1 MCULE-2672517245 [0,0,0,0,2,0|1,0,1]=4 1024 B12R1.30 CC(NCCO)C1=CC=CC=C1 MCULE-6045242627 [0,0,0,0,2,0|1,0,1]=4 1025 B12R1.30 CCCCC(=O)C1=CC=CC=C1 MCULE-2120491215 [0,0,0,0,2,0|2,0,0]=4 1026 B12R1.30 CCCNC(=O)C1=CC=CC=C1 MCULE-4241205995 [0,0,0,0,2,0|1,0,0]=3 1027 B12R1.30 CCCNC(=O)C1=CN=CC=C1 MCULE-6346494359 [0,0,0,0,2,0|2,0,0]=4 1028 B12R1.30 CCCOC(=O)C1=CC=CC=C1 MCULE-8178011188 [0,0,0,0,2,0|2,0,0]=4 1029 B12R1.30 CCNNC(=O)C1=CC=CC=C1 MCULE-4553557168 [0,0,0,0,2,0|2,0,0]=4 1030 B12R1.30 CCONC(=O)C1=CC=CC=C1 MCULE-7749362693 [0,0,0,0,2,0|2,0,0]=4 1031 B12R1.30 C[C@@H](NCCO)C1=CC=CC=C1 MCULE-2129664411 [0,0,0,0,2,0|1,0,1]=4 1032 B12R1.30 C[C@@H](NCCO)C1=CC=CC=C1 MCULE-7330953105 [0,0,0,0,2,0|1,0,1]=4 1033 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 MCULE-1337308037 [0,0,0,0,2,0|1,0,1]=4 1034 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 MCULE-9436913854 [0,0,0,0,2,0|1,0,1]=4 1035 B12R1.30 N#CCNC(=O)C1=CC=CC=C1 MCULE-4316376234 [0,0,0,0,2,0|1,0,1]=4 1036 B12R1.30 NCCNC(=O)C1=CC=CC=C1 MCULE-5943442537 [0,0,0,0,2,0|1,0,0]=3 1037 B12R1.30 NCCNC(=O)C1=CC=CC=C1 MCULE-7097378808 [0,0,0,0,2,0|1,0,0]=3 1038 B12R1.30 NCCNC(=O)C1=CC=CN=C1 MCULE-7937300281 [0,0,0,0,2,0|2,0,0]=4 1039 B12R1.30 NCCNC(=O)C1=CC=CN=C1 MCULE-8797469595 [0,0,0,0,2,0|2,0,0]=4 1040 B12R1.30 NCCNC(=O)C1=CC=NC=C1 MCULE-2005462801 [0,0,0,0,2,0|2,0,0]=4 1041 B12R1.30 NCCNC(=O)C1=CC=NC=C1 MCULE-8675682008 [0,0,0,0,2,0|2,0,0]=4 1042 B12R1.30 NCCNC(=O)C1=CN=CC=C1 MCULE-7734585237 [0,0,0,0,2,0|2,0,0]=4 1043 B12R1.30 NCCNC(=O)C1=NC=CC=C1 MCULE-6024521213 [0,0,0,0,2,0|2,0,0]=4 1044 B12R1.30 NCCNC(=O)C1=NC=CC=C1 MCULE-9699292471 [0,0,0,0,2,0|2,0,0]=4 1045 B12R1.30 O=C(C#CCO)C1=CC=CC=C1 MCULE-3940439758 [0,0,0,0,2,0|1,0,1]=4 1046 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 MCULE-2148211370 [0,0,0,0,2,0|2,0,0]=4 1047 B12R1.30 O=C(CCCO)C1=CC=CC=C1 MCULE-5662678881 [0,0,0,0,2,0|1,0,0]=3 1048 B12R1.30 O=C(CCCO)C1=CC=CN=C1 MCULE-2625192486 [0,0,0,0,2,0|2,0,0]=4 1049 B12R1.30 O=C(NCCBr)C1=NC=CC=C1 MCULE-5299741236 [0,0,0,0,2,0|2,0,0]=4 1050 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 MCULE-5248066172 [0,0,0,0,2,0|1,0,0]=3 1051 B12R1.30 O=C(NCCCl)C1=CC=CN=C1 MCULE-7161264124 [0,0,0,0,2,0|2,0,0]=4 1052 B12R1.30 O=C(NCCCl)C1=CC=CN=C1 MCULE-9757858829 [0,0,0,0,2,0|2,0,0]=4 1053 B12R1.30 O=C(NCCCl)C1=CC=NC=C1 MCULE-2618123008 [0,0,0,0,2,0|2,0,0]=4 1054 B12R1.30 O=C(NCCCl)C1=CC=NC=C1 MCULE-5032663326 [0,0,0,0,2,0|2,0,0]=4 1055 B12R1.30 O=C(NCCO)C1=CC=CC=C1 MCULE-2581769437 [0,0,0,0,2,0|0,0,0]=2 1056 B12R1.30 O=C(NCCO)C1=CC=NC=C1 MCULE-7948975464 [0,0,0,0,2,0|1,0,0]=3 1057 B12R1.30 O=C(NCCO)C1=CN=CC=C1 MCULE-9796813027 [0,0,0,0,2,0|1,0,0]=3 1058 B12R1.30 O=C(NCCO)C1=NC=CC=C1 MCULE-2801929441 [0,0,0,0,2,0|1,0,0]=3 1059 B12R1.30 O=C(NCCO)C1=NC=CC=C1 MCULE-6223282344 [0,0,0,0,2,0|1,0,0]=3 1060 B12R1.30 O=C(NCCO)C1=NC=CN=C1 MCULE-4745733879 [0,0,0,0,2,0|2,0,0]=4 1061 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 MCULE-9574981361 [0,0,0,0,2,0|2,0,0]=4 1062 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 MCULE-3499936969 [0,0,0,0,2,0|2,0,0]=4 1063 B12R1.30 O=C(OCCI)C1=CC=CC=C1 MCULE-3515879165 [0,0,0,0,2,0|2,0,0]=4 1064 B12R1.30 O=C(OCCO)C1=CC=CC=C1 MCULE-8134930207 [0,0,0,0,2,0|1,0,0]=3 1065 B12R1.30 O=C(OCCO)C1=CC=CN=C1 MCULE-5291351600 [0,0,0,0,2,0|2,0,0]=4 1066 B12R1.30 O=C(SCCS)C1=CC=CC=C1 MCULE-2283197813 [0,0,0,0,2,0|1,1,0]=4 1067 B12R1.30 O=S(CCCO)C1=CC=CC=C1 MCULE-2389154282 [0,0,0,0,2,0|2,0,0]=4 1068 B12R1.30 OCCNC(=S)C1=CC=CC=C1 MCULE-5492035765 [0,0,0,0,2,0|0,1,0]=3 1069 B12R1.53 O=C(CC1=CC=CS1)NCCO MCULE-9155400636 [0,0,0,0,2,0|1,0,1]=4